Basic information
- CAS
152928-13-7- Standard SMILES
CCOC(=O)Nc1ccc(O)c(C(=O)O)c1- InChIKey
SJXSGPSMJJLOAG-UHFFFAOYSA-N- Molecular formula
- C10H11NO5
- Average molar mass
- 225.2 g/mol
- Monoisotopic mass
- 225.06372245
Names & identifiers
- Preferred name
- 5-[(Ethoxycarbonyl)amino]-2-hydroxybenzoic acid
- IUPAC
- 5-(ethoxycarbonylamino)-2-hydroxybenzoic acid
Names & synonyms
152928-13-75-[(Ethoxycarbonyl)amino]-2-hydroxybenzoic acidSCHEMBL597309DTXSID70597255AKOS000148545
Database identifiers
- CAS
152928-13-7- PubChem CID
- 19001046
- DTXSID
DTXSID70597255
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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