Basic information
- CAS
518335-96-1- Standard SMILES
O=C(O)c1ccc(NC2CCCC2)cc1- InChIKey
NKHOUDMZYQDBQE-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
Names & identifiers
- Preferred name
- Benzoic acid, 4-(cyclopentylamino)-
- IUPAC
- 4-(cyclopentylamino)benzoic acid
- English name
- Benzoic acid, 4-(cyclopentylamino)- (9CI)
- Molecular formula
- C12H15NO2
- Molecular weight
- 205.25
Names & synonyms
518335-96-1SCHEMBL1663449Benzoic acid, 4-(cyclopentylamino)-DB-325926Benzoic acid, 4-(cyclopentylamino)- (9CI)
Database identifiers
- CAS
518335-96-1
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 216
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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