m,alpha-Dichlorotoluene

HCID 178919811CAS 130468-19-8

基本情報

標準SMILES: ClCc1cccc(Cl)c1
InChIKey: DDGRAFHHXYIQQR-UHFFFAOYSA-N
分子式: C7H6Cl2
平均分子量: 161.03 g/mol

名称と識別子

優先名称: m,alpha-Dichlorotoluene
IUPAC: 1-chloro-3-(chloromethyl)benzene
英語名: Benzene, 1-chloro-3-(chloromethyl)-, radical ion(1-) (9CI)
分子式: C7H6Cl2
分子量: 161.03

名称と別名

3-Chlorobenzyl chloride620-20-21-Chloro-3-(chloromethyl)benzenealpha,3-DichlorotolueneBenzene, 1-chloro-3-(chloromethyl)-M-CHLOROBENZYL CHLORIDEm-Chlorbenzyl chloridem,alpha-DichlorotolueneDTXSID2057786Toluene, m,alpha-dichloro-QXH4Y96Y2LEINECS 210-629-4

名称をさらに表示

Benzene, 1-chloro-3-(chloromethyl)-, radical ion(1-) (9CI)

NSC 76577NSC-76577DTXCID30315751-Chloro-3-(chloromethyl)-benzeneRefChem:800323Toluene, m,alpha-dichloro-(8CI)210-629-43-Chlorobenzylchloride

データベース識別子

CAS: 130468-19-8
ChEMBL: CHEMBL3561692
UNII: QXH4Y96Y2L
EC Number: 210-629-4
Nikkaji: J7.047E

物性

構造計算による物性

XLogP: 3.2
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 1
重原子数: 9
形式電荷: 0
複雑度: 83

実験および物理化学的性質

SpringerMaterials PropertiesDensity

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 1.4% (1 of 71) of reports.

Danger

H302 (25.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 71 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationChemical: Benzene, 1-chloro-3-(chloromethyl)-

Hazard Classes and CategoriesAcute Tox. 4 (25.4%)

化学と産業

用途と製造

General Manufacturing InformationBenzene, 1-chloro-3-(chloromethyl)-: ACTIVE

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