CAS 116632-42-9 2-Chloro-1-iodo-4-methylbenzene (HCID 2757618)

基本情報

CAS: 116632-42-9
標準SMILES: Cc1ccc(I)c(Cl)c1
InChIKey: IFXSHBHXDHPWEO-UHFFFAOYSA-N
分子式: C7H6ClI
平均分子量: 252.48 g/mol
単同位体質量: 251.92028

名称と識別子

優先名称: 2-Chloro-1-iodo-4-methylbenzene
IUPAC: 2-chloro-1-iodo-4-methylbenzene
現地名: 3-クロロ-4-ヨードトルエン
英語名: 3-Chloro-4-iodotoluene
分子式: C7H6ClI
分子量: 252.48

名称と別名

2-chloro-1-iodo-4-methylbenzeneRefChem:4685033-Chloro-4-iodotoluene116632-42-9Benzene, 2-chloro-1-iodo-4-methyl-MFCD000797342-chloro-1-iodo-4-methyl-benzene3-Chloro-4-iodo-tolueneSCHEMBL551259SCHEMBL7007203DTXSID70373975IFXSHBHXDHPWEO-UHFFFAOYSA-N

名称をさらに表示

3-クロロ-4-ヨードトルエン3-Chloro-6-iodotoluene3-CHLORO-4-IODOTOLUENE 99%

REA63242CK2354AKOS009319653AC-9819AS-62004SY016884DB-041332CS-0080413

データベース識別子

CAS: 116632-42-9
PubChem CID: 2757618
DTXSID: DTXSID70373975
EC Number: 674-031-9
Nikkaji: J2.388.765G

物性

構造計算による物性

XLogP: 3.6
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: 0
重原子数: 9
形式電荷: 0
複雑度: 94

物理化学的性質

沸点: 140 °C · 140 °C
比重(密度): 1 · 1,82 g/cm3
闪点: 105 ℃ · 105℃
貯蔵温度: 2 · 2-8°C, protect from light
比重: 1.82 · 1.82
CAS データベース: 116632 · 116632-42-9(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 2 reports by companies from 2 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.