Basic information
- CAS
886367-31-3- Standard SMILES
O=C(O)c1nc(-c2cccc(F)c2)cs1- InChIKey
BPKUFKUYYAWBEM-UHFFFAOYSA-N- Molecular formula
- C10H6FNO2S
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.01032777
Names & identifiers
- Preferred name
- 4-(3-Fluoro-phenyl)-thiazole-2-carboxylic acid
- IUPAC
- 4-(3-fluorophenyl)-1,3-thiazole-2-carboxylic acid
- English name
- 4-(3-Fluoro-phenyl)-thiazole-2-carboxylic acid
- Molecular formula
- C10H6FNO2S
- Molecular weight
- 223.22
Names & synonyms
886367-31-34-(3-FLUORO-PHENYL)-THIAZOLE-2-CARBOXYLIC ACID4-(3-FLUOROPHENYL)THIAZOLE-2-CARBOXYLIC ACID4-(3-FLUOROPHENYL)-1,3-THIAZOLE-2-CARBOXYLIC ACIDSCHEMBL31401008DTXSID40695333AKOS017560583AB41471DB-3486094-(3-FLUOROPHENYL)THIAZOLE-2-CARBOXYLICACID2-Thiazolecarboxylic acid, 4-(3-fluorophenyl)-
Database identifiers
- CAS
886367-31-3- PubChem CID
- 53404151
- DTXSID
DTXSID40695333
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
Chemistry & industry
Suppliers3 total
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
上海洪创医药科技有限公司18151128828 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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