Basic information
- CAS
6935-15-5- Standard SMILES
O=C(Nc1ccc(C(=O)O)c(O)c1)OCc1ccccc1- InChIKey
YCGSSGSFSHXDCV-UHFFFAOYSA-N- Molecular formula
- C15H13NO5
- Average molar mass
- 287.27 g/mol
- Monoisotopic mass
- 287.07937252
Names & identifiers
- Preferred name
- 4-{[(Benzyloxy)carbonyl]amino}-2-hydroxybenzoic acid
- IUPAC
- 2-hydroxy-4-(phenylmethoxycarbonylamino)benzoic acid
Names & synonyms
4-{[(benzyloxy)carbonyl]amino}-2-hydroxybenzoic acid6935-15-54-(((Benzyloxy)carbonyl)amino)-2-hydroxybenzoic acidNSC58599SCHEMBL2293225DTXSID10289026YCGSSGSFSHXDCV-UHFFFAOYSA-NNSC-58599AKOS000182302EN300-1207804-{[(benzyloxy)carbonyl]amino}-2-hydroxy benzoic acid
Database identifiers
- CAS
6935-15-5- PubChem CID
- 246030
- DTXSID
DTXSID10289026
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 367
Related reactions
5 records
Compound notes
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