기본 정보
- 표준 SMILES
CSC(=N)N.CSC(=N)N.O=S(=O)(O)O- InChIKey
BZZXQZOBAUXLHZ-UHFFFAOYSA-N- 분자식
- C4H14N4O4S3
- 평균 분자량
- 278.4 g/mol
개요
See also: 2-Methyl-2-thiopseudourea (annotation moved to) ... View More ...
이름 및 식별자
- 우선 이름
- Bis(S-methylisothiouronium) sulfate
- IUPAC
- methyl carbamimidothioate;sulfuric acid
이름 및 동의어
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
이름 더 보기
Carbamimidothioic acid, methyl-, sulfate (2:1)S-METHYLISOTHIOUREA SEMISULFATEMETHYLISOTHIOUREA SULFATE (2:1)S-METHYLISOTHIOURONIUM HEMISULFATEMETHYLTHIOFORMAMIDINE SULFATE (2:1)S-METHYLISOTHIOUREA HEMISULFURIC ACID SALTRefChem:569270DTXCID7048536
데이터베이스 식별자
- CAS
867-44-7- PubChem CID
- 13347
- ChEMBL
CHEMBL1358112- UNII
- H834R05C26
- EC Number
- 212-759-7
물성
구조 계산 물성
- 극성 표면적
- 233 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 124
안전 및 규제
GHS 분류
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.
유해성 정보
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%)
화학 및 산업
용도 및 제조
General Manufacturing InformationCarbamimidothioic acid, methyl ester, sulfate (2:1): INACTIVE
관련 반응
17건
연결된 노트
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