Basic information
- CAS
10354-43-5- Standard SMILES
O=C(NCc1ccccc1)c1cccs1- InChIKey
WCGCLWNPEQTVSG-UHFFFAOYSA-N- Molecular formula
- C12H11NOS
- Average molar mass
- 217.29 g/mol
- Monoisotopic mass
- 217.05613515
Names & identifiers
- Preferred name
- N-benzylthiophene-2-carboxamide
- IUPAC
- N-benzylthiophene-2-carboxamide
- English name
- 2-Thiophenecarboxamide, N-(phenylmethyl)-
- Molecular formula
- C12H11NOS
- Molecular weight
- 217.29
Names & synonyms
N-benzylthiophene-2-carboxamide10354-43-5DTXSID70341593RefChem:363461DTXCID90292674N-Benzyl-2-thiophenecarboxamide2-Thiophenecarboxamide, N-(phenylmethyl)-Cambridge id 5245866N-benzyl-2-thienylcarboxamideSCHEMBL2925459SCHEMBL3350937N-Benzyl-2-thiophenecarboxamide #
Show more names
N-(Phenylmethyl)-2-thiophenecarboxamide
Thiophene-2-carboxamide, N-benzyl-STK411102AKOS002161010ST45185191Z27749659
Database identifiers
- CAS
10354-43-5- PubChem CID
- 574227
- DTXSID
DTXSID70341593- Nikkaji
- J786.469H
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Melting point
- 119.5 · 119.5-120.5 °C
- Boiling point
- 442.7 · 442.7±28.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- pka
- 14.67 · 14.67±0.46(Predicted)
Chemistry & industry
Suppliers2 total
武汉鑫晟阳生物科技有限公司18402740988 18402740988 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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