HCID86086993

2,6-Dichloro-3,5-dimethoxyphenyl isocyanate

2,4-dichloro-3-isocyanato-1,5-dimethoxybenzene

C9H7Cl2NO3248.06 g/molCAS 872511-32-5

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IDENTITY

结构与身份

标准SMILES: COc1cc(OC)c(Cl)c(N=C=O)c1Cl
InChIKey: VJFDWELAHZSVEE-UHFFFAOYSA-N
分子式: C9H7Cl2NO3
平均分子量: 248.06 g/mol
单同位素质量: 246.9802985

COMPUTED

结构计算性质

已同步

XLogP: 3.9
极性表面积: 47.9 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 3
重原子: 15
形式电荷: 0
复杂度: 242

GHS

GHS分类

GHS Classification

Warning

H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, 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.

HAZARDS

危害信息

Hazard Classes and Categories

Skin Sens. 1 (100%)

ALIASES

名称与别名

共 20 条

872511-32-52,6-Dichloro-3,5-dimethoxyphenyl isocyanateRefChem:445362826-586-52,4-dichloro-3-isocyanato-1,5-dimethoxybenzene2,4-Dichloro-3-isocyanato-1,5-dimethoxy-benzeneMFCD263986472,6-dichloro-3,5-dimethoxyphenylisocyanateSCHEMBL374141Benzene, 2,4-dichloro-3-isocyanato-1,5-dimethoxy-PS-17790E805062,6-dichloro-A900839VJFDWELAHZSVEE-UHFFFAOYSA-NAC-37284SY233446DB-3296692,6-dichloro-3,5-dimethoxyphenyl-isocyanateF826493

REACTIONS