4-Amino-2-(ethylamino)benzoic acid
Basic information
- CAS
2486-53-5- Standard SMILES
CCNc1cc(N)ccc1C(=O)O- InChIKey
NBNWGQCRCHQBHN-UHFFFAOYSA-N- Molecular formula
- C9H12N2O2
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.08987763
Names & identifiers
- Preferred name
- 4-Amino-2-(ethylamino)benzoic acid
- IUPAC
- 4-amino-2-(ethylamino)benzoic acid
Names & synonyms
2486-53-54-amino-2-(ethylamino)benzoic acidSCHEMBL18677636DTXSID301297716AKOS013367145DA-21482
Database identifiers
- CAS
2486-53-5- PubChem CID
- 64050396
- DTXSID
DTXSID301297716
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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