CAS 4490-10-2 Geranyl chloride (HCID 6372219)

基本情報

CAS: 4490-10-2
標準SMILES: CC(C)=CCC/C(C)=C/CCl
InChIKey: WLAUCMCTKPXDIY-JXMROGBWSA-N
分子式: C10H17Cl
平均分子量: 172.69 g/mol
単同位体質量: 172.10187822

名称と識別子

優先名称: Geranyl chloride
IUPAC: (2E)-1-chloro-3,7-dimethylocta-2,6-diene

名称と別名

Geranyl chloride5389-87-7(E)-1-Chloro-3,7-dimethyl-2,6-octadiene2,6-Octadiene, 1-chloro-3,7-dimethyl-, (E)-NSC 177220RefChem:142978611-062-9(E)-1-Chloro-3,7-dimethylocta-2,6-diene1-Chloro-3,7-dimethylocta-2,6-diene(2E)-1-chloro-3,7-dimethylocta-2,6-diene4490-10-21-geranylchloride

名称をさらに表示

2,6-Octadiene, 1-chloro-3,7-dimethyl-(E)-8-Chloro-2,6-dimethyl-2,6-octadieneMFCD000009832,6-Octadiene, 1-chloro-3,7-dimethyl-, (2E)-(6E)-8-CHLORO-2,6-DIMETHYLOCTA-2,6-DIENEDTXSID301316702EINECS 224-783-5AKOS015903298

データベース識別子

CAS: 4490-10-2、5389-87-7
PubChem CID: 6372219
DTXSID: DTXSID301316702
UNII: NZQ4T3YT47
EC Number: 224-783-5、611-062-9
Nikkaji: J29.185D、J428.541G

物性

構造計算による物性

XLogP: 4.2
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: 4
重原子数: 11
形式電荷: 0
複雑度: 150

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.