CAS: 628-73-9; Hexanenitrile

该化合物是一种有机化合物,其特征为六碳链,在一端有硝化功能组(-CN),其分子式为C6H11N,并被归类为线性丙烯酸.乙烷硝基苯是一种无色液体,在室温下呈现出微弱的气味,呈现出杏仁的微微微的微粒,在乙醇和乙醇等有机溶剂中溶解,但由于其含水的碳氢化合物链,该化合物在水中溶解性有限.该化合物主要用于有机合成,并作为中间体生产各种化学品,包括药品和农用化学物.乙烷硝基苯三烯可经受典型的硝酸反应,如水解以形成碳酸或氨酸或氨酸.重要的是,要谨慎处理这一化合物,因为硝酸可能会有毒,在接触时可能构成健康风险.在实验室或工业环境中与六硝基锡一起工作时,应观察适当的安全措施,包括使用个人防护设备.

结构式图片

欧盟法规

ECHA物质C&L通报REACH预注册

上下游产品

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合成工艺路线路线简述

    己酸置于2,3,4,5,6-Pentahydroxy-Hexanal,羟胺,Magnesium Sulfate,Aldoxime Dehydratase From Corynebacteriumpacaense Marseille-P2417,Carboxylic Acid Reductase From Neurospora Crassa体系中,用 正庚烷 作为反应溶剂,化学反应 4.5H,反应生成 已腈
    参考文献:有机酸制腈:化学酶促三步路线
    标题:有机酸制腈:化学酶促三步路线
    摘要:各种广泛应用的化合物都含有氰基,该官能团可作为各种不同反应的化学手柄.我们报告了用于腈合成的无氰化物化学酶促级联.反应途径始于通过用作活细胞生物催化剂的羧酸还原酶 (Car) 将羧酸还原为醛.第二个--化学--步骤包括原位与羟胺形成肟.从肟到腈的最后直接步骤是由醛肟脱水酶 (Oxds) 催化的.使用 Car 和 Oxd 的相容组合,应用于一锅两步反应,以超过 80% 的转化率获得了几种脂肪族和芳基-脂肪族目标腈.例如,苯乙腈的分离产率为 78%.与完全化学过程相比,这种化学酶促途径不需要氰化物盐,有毒金属或不需要的氧化剂.
    DOI:10.1002/adsc.202201053

    海关参考信息

    专利信息


    专利号:US-2023312617-A1
    优先权日:2020-07-25
    标题 :Process for synthesis of organosilicon compounds from halosilanes
    发明人:DOLAI SUKANTA; BHAT SHREEDHAR; TARAFDAR GOURAV
    权利人:MOMENTIVE PERFORMANCE MAT INC
    摘要:A process for synthesis of an organosilicon compound is provided herein. Also, novel organosilicon compounds prepared by the present process is provided herein. The process comprises the reaction of a halosilane with an organofunctional alkyl halide in the presence of a metal catalyst, a promoter, and an optional co-catalyst. The process provides an efficient synthetic route to produce organosilicon compounds. The process also allows synthesis of organosilicon compounds with a plurality of different functional groups.

    专利号:US-7759520-B2
    优先权日:1996-11-27
    标 题 :Synthesis of selective androgen receptor modulators
    发明人:DALTON JAMES T; MILLER DUANE D; YIN DONGHUA; HE YALI
    权利人:UNIV TENNESSEE RES FOUNDATION
    摘要:The present invention relates to a synthetic process for the preparation of a novel class of androgen receptor targeting agents (ARTA) which demonstrate androgenic and anabolic activity of a nonsteroidal ligand for the androgen receptor. The agents define a new subclass of compounds which are selective androgen receptor modulators (SARM) which are useful for a) male contraception; b) treatment of a variety of hormone-related conditions, for example conditions associated with Androgen Decline in Aging Male (ADAM), such as fatigue, depression, decreased libido, sexual dysfunction, erectile dysfunction, hypogonadism, osteoporosis, hair loss, anemia, obesity, sarcopenia, osteopenia, osteoporosis, benign prostate hyperplasia, alterations in mood and cognition and prostate cancer; c) treatment of conditions associated with Androgen Decline in Female (ADIF), such as sexual dysfunction, decreased sexual libido, hypogonadism, sarcopenia, osteopenia, osteoporosis, alterations in cognition and mood, depression, anemia, hair loss, obesity, endometriosis, breast cancer, uterine cancer and ovarian cancer; d) treatment and/or prevention of chronic muscular wasting; e) decreasing the incidence of, halting or causing a regression of prostate cancer; f) oral androgen relacement and/or other clinical therpauetic and/or diagnostic areas. The process of the present invention is suitable for large-scale preparation, since all of the steps give rise to highly pure compounds, thus avoiding complicated purification procedures which ultimately lower the yield. Thus the present invention provides methods for the synthesis of non-steroidal agonist compounds, that can be used for industrial large-scale synthesis, and that provide highly pure products in high yield.

    专利号:US-6995284-B2
    优先权日:2000-08-24
    标题 :Synthesis of selective androgen receptor modulators
    发明人:DALTON JAMES T; MILLER DUANE D; HE YALI; YIN DONGHUA
    权利人:UNIV TENNESSEE RES FOUNDATION
    摘要:The present invention relates to a synthetic process for the preparation of a novel class of androgen receptor targeting agents (ARTA) which demonstrate androgenic and anabolic activity of a nonsteroidal ligand for the androgen receptor. The agents define a new subclass of compounds which are selective androgen receptor modulators (SARM) which are useful for a) male contraception; b) treatment of a variety of hormone-related conditions, for example conditions associated with Androgen Decline in Aging Male (ADAM), such as fatigue, depression, decreased libido, sexual dysfunction, erectile dysfunction, hypogonadism, osteoporosis, hair loss, anemia, obesity, sarcopenia, osteopenia, osteoporosis, benign prostate hyperplasia, alterations in mood and cognition and prostate cancer; c) treatment of conditions associated with Androgen Decline in Female (ADIF), such as sexual dysfunction, decreased sexual libido, hypogonadism, sarcopenia, osteopenia, osteoporosis, alterations in cognition and mood, depression, anemia, hair loss, obesity, endometriosis, breast cancer, uterine cancer and ovarian cancer; d) treatment and/or prevention of chronic muscular wasting; e) decreasing the incidence of, halting or causing a regression of prostate cancer; f) oral androgen relacement and/or other clinical therpauetic and/or diagnostic areas. The process of the present invention is suitable for large-scale preparation, since all of the steps give rise to highly pure compounds, thus avoiding complicated purification procedures which ultimately lower the yield. Thus the present invention provides methods for the synthesis of non-steroidal agonist compounds, that can be used for industrial large-scale synthesis, and that provide highly pure products in high yield.

    专利号:US-6337393-B1
    优先权日:1997-11-13
    标 题:Method and composition for chemical synthesis on an open environment support surface using high boiling point organic solvents to control evaporation
    发明人:BRENNAN THOMAS M; FRAUENDORF ALBRECHT W
    权利人:PROTOGENE LAB INC
    摘要:A method for reducing evaporation of a liquid reagent solution during solid phase, micro-scale chemical synthesis of a molecule comprising sub-units on an open environment solid support surface. The method includes the steps of providing an open solid support surface including at least one binding site which is functionalized with a reactive chemical moiety; and depositing a substantially controlled and minute volume of liquid reagent solution onto the support surface, and in contact with the binding site. The reagent solution includes reactants contained in at least one relatively high boiling point solvent, in contrast to standard organic solvents for such reagents. Application of a high boiling point solvent substantially reduces evaporation of the reagent solution in the open environment during synthesis on the solid support while enabling the maintenance of a substantially high reaction yield.

    专利号:US-3950389-A
    优先权日:1968-10-04
    标 题 :Stereospecific total steroidal synthesis via substituted C/D-trans indanones
    发明人:HAJOS ZOLTAN GEORGE
    权利人:HOFFMANN LA ROCHE
    摘要:Total synthesis of known progestationally active steroidal materials. The steroids can be synthesized depending on the particular starting reactants selected by employing as intermediates bicyclic compounds of the formula ##SPC1## n Wherein m is an integer having a value of 1 or 2; R 4 is hydrogen or lower alkyl; Z is lower alkylenedioxymethylene CH(OR 2 ) and carbonyl; R 8 when taken alone is hydrogen; R 9 when taken alone is lower alkoxycarbonyl, aryloxy-carbonyl, lower cycloalkyloxycarbonyl, carbonyl-halide, hydrogen, carboxy, formyl and methylene-X, where X is a leaving group and when taken together are methylene; with the proviso that when Z is carbonyl R 8 when taken alone is hydrogen; R 9 when taken alone is carbonyl halide, hydrogen, carboxy, formyl and methylene-X where X is a leaving group and when taken together are methylene and R 2 is hydrogen, lower alkyl, lower alkoxy-lower alkyl, phenyl-lower alkyl, tetrahydropyranyl, lower alkanoyl, benzoyl, nitrobenzoyl, carboxy-lower alkanoyl, carboxybenzoyl, trifluoroacetyl and camphorsulfonyl n And reacting them in the case where R 8 and R 9 taken together are methylene or R 8 is hydrogen and R 9 is methylene-X with β-keto esters and other analogs of the formula ##EQU1## wherein R.sub. 6 is selected from the group CONSISTING OF ##EQU2## and LOWER ALKYL; R 7 is lower alkyl; R 15 is selected from the group consisting of oxo, lower alkylene-dioxy or (hydrogen and lower alkoxy); B is selected from the group consisting of lower alkoxy-carbonyl-methylene, lower-aryloxy-carbonyl-methylene, cyanomethylene, lower alkyl sulfinyl-methylene, lower alkyl sulfonyl-methylene, and R 25 and R 26 are independently selected from the group consisting of hydrogen, hydroxyl and lower alkyl.

    专利号:US-4077983-A
    优先权日:1974-06-24
    标 题:Stereospecific total steroidal synthesis via substituted C/D-trans indanones
    发明人:HAJOS ZOLTAN GEORGE
    权利人:HOFFMANN LA ROCHE
    摘要:Total synthesis of known progestationally active steroidal materials. The steroids can be synthesized depending on the particular starting reactants selected by employing as intermediates bicyclic compounds of the formula ##STR1## wherein m is an integer having a value of 1 or 2; R 4 is hydrogen or lower alkyl; Z is lower alkylenedioxy, CH(OR 2 ) and carbonyl; R 8 when taken alone is hydrogen; R 9 when taken alone is lower alkoxycarbonyl, aryloxy-carbonyl, lower cycloalkyloxycarbonyl, carbonyl-halide, hydrogen, carboxy, formyl and methylene-X, where X is a leaving group and when taken together are methylene; with the proviso that when Z is carbonyl R 8 when taken alone is hydrogen; R 9 when taken alone is carbonyl halide, hydrogen, carboxy, formyl and methylene-X where X is a leaving group and when taken together are methylene and R 2 is hydrogen, lower alkyl, lower alkoxy-lower alkyl, phenyl-lower alkyl, tetrahydropyranyl, lower alkanoyl, benzoyl, nitrobenzoyl, carboxy-lower alkanoyl, carboxybenzoyl, trifluoroacetyl and camphorsulfonyl n And reacting then in the case where R 8 and R 9 taken together are methylene or R 8 is hydrogen and R 9 is methylene-X with β-keto esters and other analogs of the formula ##STR2## wherein R 6 is selected from the group consisting of ##STR3## lower alkyl; R 7 is lower alkyl; R 15 is selected from the group consisting of oxo, lower alkylenedioxy or (hydrogen and lower alkoxy); B is selected from the group consisting of lower alkoxy-carbonylmethylene, lower-aryloxy-carbonyl-methylene, cyanomethylene, lower alkyl sulfinyl-methylene, lower alkyl sulfonyl-methylene, and R 25 and R 26 are independently selected from the group consisting of hydrogen, hydroxyl and lower alkyl.
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    主要参考文献


    1: van Dijk AJ, Duchateau R, Hensen EJ, Meuldijk J, Koning CE. Polyamide synthesis from 6-aminocapronitrile, part
    2: heterogeneously catalyzed nitrile hydrolysis with consecutive amine amidation. Chemistry. 2007;13(27):7673-81. doi: 10.1002/chem.200601898. 59(Pt 2):248-53. doi: 10.1099/ijs.0.002204-0.

    合成参考文献


    摘要:Negishi, E.; Wang, G., Science of Synthesis, (2009) 46, 326.
    摘要:von Angerer, S., Science of Synthesis Knowledge Updates, (2011) 1, 124.
    摘要:Marsden, S. P., Science of Synthesis: Cross Coupling and Heck-Type Reactions, (2012) 2, 607.
    摘要:Faber, K.; Glueck, S. M.; Hammer, S. C.; Hauer, B.; Nestl, B. M., Science of Synthesis: Biocatalysis in Organic Synthesis, (2015) 3, 571.
    摘要:Nippon Eiseigaku Zasshi. Japanese Journal of Hygiene., 39(423), 1984
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