Basic information
- CAS
519056-60-1- Standard SMILES
NC(=S)c1ccc(N2CCOCC2)cc1- InChIKey
KOPFTYFPHHZQCH-UHFFFAOYSA-N- Molecular formula
- C11H14N2OS
- Average molar mass
- 222.31 g/mol
- Monoisotopic mass
- 222.08268407
Names & identifiers
- Preferred name
- 4-Morpholinobenzenecarbothioamide
- IUPAC
- 4-morpholin-4-ylbenzenecarbothioamide
- English name
- 4-Morpholinobenzenecarbothioamide
- Molecular formula
- C11H14N2OS
- Molecular weight
- 222.31
Names & synonyms
4-morpholinobenzenecarbothioamide519056-60-14-Morpholinobenzothioamide4-(morpholin-4-yl)benzene-1-carbothioamide4-morpholin-4-ylbenzenecarbothioamide4-(Morpholin-4'-y)lthiobenzamideMFCD041153794-(morpholin-4-yl)benzenecarbothioamideSCHEMBL15285555DTXSID10383634KOPFTYFPHHZQCH-UHFFFAOYSA-NSBB096354
Show more names
Benzenecarbothioamide, 4-(4-morpholinyl)-4-(morpholin-4-yl)benzenecarbothioamide - [AC78473]
AKOS000218197MS-22182DB-071454CS-0268346amino(4-morpholin-4-ylphenyl)methane-1-thioneEN300-1826333F316511
Database identifiers
- CAS
519056-60-1- PubChem CID
- 2795360
- DTXSID
DTXSID10383634
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 221
Chemistry & industry
Suppliers6 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
Related reactions
2 records
Compound notes
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