基本情報
- 標準SMILES
CSC(=N)N.CSC(=N)N.O=S(=O)(O)O- InChIKey
BZZXQZOBAUXLHZ-UHFFFAOYSA-N- 分子式
- C4H14N4O4S3
- 平均分子量
- 278.4 g/mol
概要
See also: 2-Methyl-2-thiopseudourea (annotation moved to) ... View More ...
名称と識別子
- 優先名称
- Bis(S-methylisothiouronium) sulfate
- IUPAC
- methyl carbamimidothioate;sulfuric acid
名称と別名
867-44-7S-Methylisothiourea hemisulfateCarbamimidothioic acid, methyl ester, sulfate (2:1)Bis(S-methylisothiouronium) sulfateS-Methylisothiourea sulfate (2:1)S-Methylthiouronium sulfate (2:1)Bis(2-methylisothiouronium) sulphateNSC 5162-Methyl-2-thiopseudourea sulfate (2:1)EINECS 212-759-7AI3-50026NSC-516
名称をさらに表示
Carbamimidothioic acid, methyl-, sulfate (2:1)S-METHYLISOTHIOUREA SEMISULFATEMETHYLISOTHIOUREA SULFATE (2:1)S-METHYLISOTHIOURONIUM HEMISULFATEMETHYLTHIOFORMAMIDINE SULFATE (2:1)S-METHYLISOTHIOUREA HEMISULFURIC ACID SALTRefChem:569270DTXCID7048536
データベース識別子
- CAS
867-44-7- PubChem CID
- 13347
- ChEMBL
CHEMBL1358112- UNII
- H834R05C26
- EC Number
- 212-759-7
物性
構造計算による物性
- 極性表面積
- 233 Ų
- 水素結合供与体数
- 6
- 水素結合受容体数
- 8
- 回転可能結合数
- 2
- 重原子数
- 15
- 形式電荷
- 0
- 複雑度
- 124
安全と法規制
GHS分類
GHS Classification
Warning
H302 (98.1%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 53 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: Carbamimidothioic acid, methyl ester, sulfate (2:1)
Bis(2-methylisothiouronium) sulphate: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (98.1%)
化学と産業
用途と製造
General Manufacturing InformationCarbamimidothioic acid, methyl ester, sulfate (2:1): INACTIVE
関連反応
17 件
関連ノート
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