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Benzyl chloromethyl ether

HCID 137983CAS 35364-99-9

部分構造検索類似構造を探す

基本情報

標準SMILES: ClCOCc1ccccc1
InChIKey: LADPCMZCENPFGV-UHFFFAOYSA-N
分子式: C8H9ClO
平均分子量: 156.61 g/mol
単同位体質量: 156.0341926

名称と識別子

優先名称: Benzyl chloromethyl ether
IUPAC: chloromethoxymethylbenzene
英語名: (chloromethoxymethyl)benzene
分子式: C8H9ClO
分子量: 156.61

名称と別名

Benzyl chloromethyl ether3587-60-8RefChem:566741628-927-1chloromethoxymethylbenzene(Chloromethoxymethyl)benzene[(chloromethoxy)methyl]benzeneBenzyloxymethyl chloride((Chloromethoxy)methyl)benzene35364-99-9Chloromethoxymethyl-benzenechloromethyl benzyl ether

名称をさらに表示

BUMCl/1-((chloromethoxy)methyl)benzene

Benzene, [(chloromethoxy)methyl]-MFCD00000886Benzyl Chloromethyl Ether (90%)Benzyl Chloromethyl Ether (90per cent){(chloromethoxy)methyl}benzenebenzyl (chloromethyl) etherBOMClEINECS 252-527-2

データベース識別子

CAS: 35364-99-9、3587-60-8
PubChem CID: 137983
DTXSID: DTXSID10956786
UNII: 9GR9P34HWY
EC Number: 252-527-2、628-927-1
Nikkaji: J32.108G

物性

構造計算による物性

XLogP: 2.6
極性表面積: 9.2 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 3
重原子数: 10
形式電荷: 0
複雑度: 79

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (97.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (11.4%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (97.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H331 (11.4%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H334 (97.7%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]

P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P354+P338, P316, P317, P321, P330, P332+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.