(2,6-dimethylphenyl)methanesulfonyl Chloride

HCID 11218255

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基本情報

CAS: 540524-67-2
標準SMILES: Cc1cccc(C)c1CS(=O)(=O)Cl
InChIKey: SLVJLZHMCFBLKO-UHFFFAOYSA-N
分子式: C9H11ClO2S
平均分子量: 218.7 g/mol
単同位体質量: 218.01682827

名称と識別子

優先名称: (2,6-dimethylphenyl)methanesulfonyl Chloride
IUPAC: (2,6-dimethylphenyl)methanesulfonyl chloride
英語名: (2,6-Dimethylphenyl)methansulfonyl chloride
分子式: C9H11ClO2S
分子量: 218.7

名称と別名

(2,6-dimethylphenyl)methanesulfonyl Chloride540524-67-2DTXSID70459086RefChem:205653DTXCID70409905893-032-7(2,6-DIMETHYLPHENYL)METHANSULFONYL CHLORIDESCHEMBL1501035SLVJLZHMCFBLKO-UHFFFAOYSA-NQWA52467MFCD12403399AKOS006335681

名称をさらに表示

2,6-Dimethylbenzylsulfonyl chlorideBenzeneMethanesulfonyl chloride, 2,6-diMethyl-

SY503715(2,6-dimethylphenyl)methanesulfonylChloride2,6-dimethyl-Benzenemethanesulfonyl chlorideCS-0139463(2,6-dimethylphenyl)-methanesulfonyl chloride(2,6-dimethyl-phenyl)-methanesulfonic chlorideEN300-223495

データベース識別子

CAS: 540524-67-2
PubChem CID: 11218255
DTXSID: DTXSID70459086
EC Number: 893-032-7

物性

構造計算による物性

XLogP: 2.6
極性表面積: 42.5 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 13
形式電荷: 0
複雑度: 245

物理化学的性質

沸点: 326 ℃ · 326℃
比重(密度): 1.281 · 1.281
闪点: 151 ℃ · 151℃

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, 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.