5-Formyl-2-methoxy-4-(methylamino)benzoic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
483304-02-5- Standard SMILES
CNc1cc(OC)c(C(=O)O)cc1C=O- InChIKey
BXXZULASIQVPIW-UHFFFAOYSA-N- Molecular formula
- C10H11NO4
- Average molar mass
- 209.2 g/mol
Names & identifiers
- Preferred name
- 5-Formyl-2-methoxy-4-(methylamino)benzoic acid
- IUPAC
- 5-formyl-2-methoxy-4-(methylamino)benzoic acid
- English name
- Benzoic acid, 5-formyl-2-methoxy-4-(methylamino)- (9CI)
- Molecular formula
- C10H11NO4
- Molecular weight
- 209.2
Names & synonyms
483304-02-55-Formyl-2-methoxy-4-(methylamino)benzoic acidDB-285684Benzoic acid, 5-formyl-2-methoxy-4-(methylamino)-Benzoic acid, 5-formyl-2-methoxy-4-(methylamino)- (9CI)
Database identifiers
- CAS
483304-02-5- Nikkaji
- J1.737.052I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Boiling point
- 431.6 · 431.6±45.0 °C(Predicted)
- Density
- 1.331 · 1.331±0.06 g/cm3(Predicted)
- pka
- 4.44 · 4.44±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…