Phosphonic acid, [(2,6-dichlorophenyl)methyl]-, diethyl ester 分子结构式
HCID2795329

Phosphonic acid, [(2,6-dichlorophenyl)methyl]-, diethyl ester

1,3-dichloro-2-(diethoxyphosphorylmethyl)benzene

C11H15Cl2O3P297.11 g/molCAS 63909-56-8

IDENTITY

结构与身份

标准SMILES
CCOP(=O)(Cc1c(Cl)cccc1Cl)OCC
InChIKey
WMVJGOZIAJRFLQ-UHFFFAOYSA-N
分子式
C11H15Cl2O3P
平均分子量
297.11 g/mol
单同位素质量
296.0135867

COMPUTED

结构计算性质

已同步
XLogP
3
极性表面积
35.5 Ų
氢键供体
0
氢键受体
3
可旋转键
6
重原子
17
形式电荷
0
复杂度
255

GHS

GHS分类

GHS Classification

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

ALIASES

名称与别名

共 22 条
63909-56-8Phosphonic acid, ((2,6-dichlorophenyl)methyl)-, diethyl esterPhosphonic acid, [(2,6-dichlorophenyl)methyl]-, diethyl esterRefChem:370363Diethyl (2,6-dichlorobenzyl)phosphonate1,3-dichloro-2-(diethoxyphosphorylmethyl)benzeneMFCD00125512Diethyl [(2,6-dichlorophenyl)methyl]phosphonateDiethyl 2,6-dichlorobenzylphosphonate(2,6-Dichloro-benzyl)-phosphonic acid diethyl esterPhosphonic acid, [(2,6-dichlorophenyl)methyl]-, diethyl ester (9CI)SCHEMBL5250114DTXSID80383626WMVJGOZIAJRFLQ-UHFFFAOYSA-NAKOS017343408SY309598O,O-diethyl 2,6-dichlorobenzylphosphonateDB-220336CS-0361253E83740

REACTIONS

相关反应

9
HRID 153305 反应方程式

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

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HRID 724425 反应方程式

uspto-grants-2006_11 · 10.6084/m9.figshare.5104873.v1 · US07141587B2

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HRID 1154975 反应方程式

uspto-grants-1981_11 · 10.6084/m9.figshare.5104873.v1 · US04299615

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HRID 1154976 反应方程式

uspto-grants-1981_11 · 10.6084/m9.figshare.5104873.v1 · US04299615

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HRID 1816829 反应方程式

uspto-grants-2005_04 · 10.6084/m9.figshare.5104873.v1 · US06884890B2

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HRID 1861115 反应方程式

uspto-grants-2003_03 · 10.6084/m9.figshare.5104873.v1 · US06531491B1

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HRID 1862154 反应方程式

uspto-grants-2003_03 · 10.6084/m9.figshare.5104873.v1 · US06534524B1

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HRID 2181550 反应方程式

uspto-grants-2005_05 · 10.6084/m9.figshare.5104873.v1 · US06891044B2

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