基本情報
- 標準SMILES
SC(Cl)(Cl)Cl- InChIKey
ILSVYQNRDXIWLK-UHFFFAOYSA-N- 分子式
- CHCl3S
- 平均分子量
- 151.4 g/mol
- 単同位体質量
- 149.886454
名称と識別子
- 優先名称
- Trichloromethanethiol
- IUPAC
- trichloromethanethiol
名称と別名
TrichloromethanethiolTRICHLOROMETHYL MERCAPTAN409314-70-175-70-7RefChem:191009Methanethiol, trichloro-Trichloro-methanethiolSCHEMBL23422SCHEMBL23423ILSVYQNRDXIWLK-UHFFFAOYSA-NAKOS015899875NS00067185
データベース識別子
- CAS
409314-70-1- PubChem CID
- 6390
- Nikkaji
- J751.280E
物性
構造計算による物性
- XLogP
- 2.5
- 極性表面積
- 1 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 0
- 重原子数
- 5
- 形式電荷
- 0
- 複雑度
- 28
安全と法規制
毒性情報
Human Toxicity Excerpts
PERCHLOROMETHYL MERCAPTAN (PCM) IS A HIGHLY TOXIC VOLATILE INHALATION POISON. A FATAL CASE OF PCM INTOXICATION IS DESCRIBED TO DRAW ATTENTION TO RISKS OF OCCUPATIONAL EXPOSURE TO PCM.
A FACTORY WORKER AGED 19 YR WAS SPLASHED IN THE FACE BY PERCHLORINEMETHYLMERCAPTAN. HE HAD IRRITATION OF THE CONJUNCTIVA & RESPIRATORY MUCOSA & WITHIN 20 HR DEVELOPED EXTENSIVE DISPERSED TOXIC BRONCHOPNEUMONIA WITH GLOBAL RESPIRATORY INSUFFICIENCY & HYPERCAPNIA. HE WAS TREATED WITH ANTIBIOTICS, CARDIOTONICS & OXYGEN INHALATION. CURE WAS ACHIEVED WITHIN 14 DAYS, WITH NO SEQUELAE.
化学と産業
用途と製造
Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
関連反応
55 件
関連ノート
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