Basic information
- Standard SMILES
COc1c(C(=O)O)ccc(N)c1N- InChIKey
DLCPOTRAGFBXGB-UHFFFAOYSA-N- Molecular formula
- C8H10N2O3
- Average molar mass
- 182.18 g/mol
- Monoisotopic mass
- 182.06914219
Names & identifiers
- Preferred name
- 3,4-Diamino-2-methoxybenzoic acid
- IUPAC
- 3,4-diamino-2-methoxybenzoic acid
Names & synonyms
3,4-Diamino-2-methoxybenzoic acid251107-34-32-Methoxy-3,4-diaminobenzoic AcidSCHEMBL5387091SCHEMBL29443032DLCPOTRAGFBXGB-UHFFFAOYSA-NCS-0526622
Database identifiers
- PubChem CID
- 18504868
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 98.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
Loading…