Basic information
- CAS
23754-39-4- Standard SMILES
CCNC(=O)Nc1cccc(C(=O)O)c1- InChIKey
SBLVYUXXTSKRNY-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.08479225
Names & identifiers
- Preferred name
- 3-[(Ethylamino)carbonyl]aminobenzoic acid
- IUPAC
- 3-(ethylcarbamoylamino)benzoic acid
- English name
- 3-[(Ethylamino)carbonyl]aminobenzoic acid
- Molecular formula
- C10H12N2O3
- Molecular weight
- 208.21
Names & synonyms
23754-39-43-[(ethylamino)carbonyl]aminobenzoic acid3-(3-Ethylureido)benzoic acid3-[(ethylcarbamoyl)amino]benzoic acid3-(ethylcarbamoylamino)benzoic acidMFCD08310637m-(3-Ethylureido)benzoic acid3-(3-Ethylureido)benzoicacidSCHEMBL30443967DTXSID20342974SBLVYUXXTSKRNY-UHFFFAOYSA-NSBB094032
Show more names
Benzoic acid, 3-[[(ethylamino)carbonyl]amino]-
AKOS005073909SB78063SS-38803-[(ethylamino)carbonylamino]benzoic acid3-([(Ethylamino)carbonyl]amino)benzoic acid #
Database identifiers
- CAS
23754-39-4- PubChem CID
- 586325
- DTXSID
DTXSID20342974- Nikkaji
- J1.393.369C
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
MATRIX[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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