HCID269606

3-Chloropropyl phenyl sulfide

3-chloropropylsulfanylbenzene

C9H11ClS186.7 g/molCAS 4911-65-3

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IDENTITY

结构与身份

标准SMILES: ClCCCSc1ccccc1
InChIKey: SBRLITLVSMPPFI-UHFFFAOYSA-N
分子式: C9H11ClS
平均分子量: 186.7 g/mol
单同位素质量: 186.0269992

COMPUTED

结构计算性质

等待补全

XLogP: 3.8
极性表面积: 25.3 Å²
氢键供体: 0
氢键受体: 1
可旋转键: 4
重原子: 11
形式电荷: 0
复杂度: 89

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 28 条

3-Chloropropyl phenyl sulfide4911-65-33-chloropropylsulfanylbenzene[(3-Chloropropyl)sulfanyl]benzene(3-Chloropropyl)(phenyl)sulfaneMFCD00040122(3-chloro-propylsulfanyl)-benzeneNSC1108163-phenylthiopropylchloride3-phenylthiopropyl chloride1-Chloro-3-phenylthiopropane3-chloro-1-phenylthiopropane3-phenylthio-1-chloropropaneSCHEMBL9559771-chloro-3-phenylthio propane[(3-Chloropropyl)thio]benzene3-Phenylthio-1-chloro-propane1-chloro-3-(phenylthio)propane1-chloro-3-(phenylthio) propaneDTXSID40296687

REACTIONS

参与反应

40 条

uspto-grants-1988_02 · 10.6084/m9.figshare.5104873.v1 · US04724235

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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 (8/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-1999_01 · 10.6084/m9.figshare.5104873.v1 · US05864039

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uspto-grants-1991_10 · 10.6084/m9.figshare.5104873.v1 · US05053408

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uspto-grants-1991_10 · 10.6084/m9.figshare.5104873.v1 · US05053408

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