HCID74828

6-Chloro-1-hexanol

6-chlorohexan-1-ol

C6H13ClO136.62 g/molCAS 2009-83-8

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IDENTITY

结构与身份

标准SMILES: OCCCCCCCl
InChIKey: JNTPTNNCGDAGEJ-UHFFFAOYSA-N
分子式: C6H13ClO
平均分子量: 136.62 g/mol
单同位素质量: 136.0654927

COMPUTED

结构计算性质

等待补全

XLogP: 1.6
极性表面积: 20.2 Å²
氢键供体: 1
氢键受体: 1
可旋转键: 5
重原子: 8
形式电荷: 0
复杂度: 39

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 69 条

6-Chloro-1-hexanol6-Chlorohexan-1-ol2009-83-86-Chlorohexanol1-Hexanol, 6-chloro-1-Chloro-6-hydroxyhexaneHexamethylene chlorohydrin1-Chloro-6-hexanolomega-ChlorohexanolT2HIT6N5UFNSC 3700EINECS 217-925-2DTXSID4049240BRN 1697307AI3-61541NSC-3700EC 217-925-24-01-00-01704 (Beilstein Handbook Reference).OMEGA.-CHLOROHEXANOLDTXCID6029096

REACTIONS

参与反应

164 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07094358B2

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uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07094929B2

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uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07419620B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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