2-(((Aminocarbonyl)amino)carbonyl)benzoic acid
Basic information
- CAS
13435-16-0- Standard SMILES
NC(=O)NC(=O)c1ccccc1C(=O)O- InChIKey
ZGWSIKBJQLBUPK-UHFFFAOYSA-N- Molecular formula
- C9H8N2O4
- Average molar mass
- 208.17 g/mol
- Monoisotopic mass
- 208.04840674
Names & identifiers
- Preferred name
- 2-(((Aminocarbonyl)amino)carbonyl)benzoic acid
- IUPAC
- 2-(carbamoylcarbamoyl)benzoic acid
Names & synonyms
13435-16-0DTXSID10158667Benzoic acid, 2-(((aminocarbonyl)amino)carbonyl)-RefChem:1060437DTXCID30811582-(((Aminocarbonyl)amino)carbonyl)benzoic acidPhthalic acid monoureideN-Carbamoylphthalamic acid2-(carbamoylcarbamoyl)benzoic acidBRN 3531296Phthalamic acid, N-carbamoyl-4-09-00-03263 (Beilstein Handbook Reference)
Show more names
Benzoic acid, 2-(((aminocarbonyl)amino)carbonyl)- (9CI)AKOS0243660422-[N-(???methyl)carbamoyl]benzoic acidST50999377
Database identifiers
- CAS
13435-16-0- PubChem CID
- 83445
- DTXSID
DTXSID10158667- Nikkaji
- J30.230I
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 290
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…