![4-[(Carbamoylamino)methyl]benzoic acid structure](/static/products/1052/1052544-66-7.webp)
4-[(Carbamoylamino)methyl]benzoic acid
TL;DR: 4-[(Carbamoylamino)methyl]benzoic acid (CAS 1052544-66-7) is a chemical compound with molecular formula C9H10N2O3 and molecular weight 194.06914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(carbamoylamino)methyl]benzoic acid
Also Known As: 4-(Ureidomethyl)benzoic acid, 4-[(carbamoylamino)methyl]benzoic acid, UPCMLD00WJAB14, 4-(Ureidomethyl)benzoicacid, 4-{[(aminocarbonyl)amino]methyl}benzoic acid
Technical Specifications
| Molecular Formula | C9H10N2O3 |
| Molecular Weight | 194.06914 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.06914 Da |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
| SMILES | C1=CC(=CC=C1CNC(=O)N)C(=O)O |
| InChIKey | UZGDNWPABVDRGA-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(Carbamoylamino)methyl]benzoic acid
Property Insights of 4-[(Carbamoylamino)methyl]benzoic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(Carbamoylamino)methyl]benzoic acid. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Carbamoylamino)methyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(Carbamoylamino)methyl]benzoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-[(Carbamoylamino)methyl]benzoic acid?
The CAS number of 4-[(Carbamoylamino)methyl]benzoic acid is 1052544-66-7.
What is the molecular formula of 4-[(Carbamoylamino)methyl]benzoic acid?
The molecular formula of 4-[(Carbamoylamino)methyl]benzoic acid is C9H10N2O3.
What is the molecular weight of 4-[(Carbamoylamino)methyl]benzoic acid?
The molecular weight of 4-[(Carbamoylamino)methyl]benzoic acid is 194.06914 g/mol.
Where can I buy 4-[(Carbamoylamino)methyl]benzoic acid?
You can request a quote for 4-[(Carbamoylamino)methyl]benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(Carbamoylamino)methyl]benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-[(Carbamoylamino)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.