Carbamimidoyl-acetic acid
TL;DR: Carbamimidoyl-acetic acid (CAS 170749-59-4) is a chemical compound with molecular formula C3H6N2O2 and molecular weight 102.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-3-iminopropanoic acid
Also Known As: Carbamimidoyl-acetic acid, 3-amino-3-iminopropanoic acid, guanylacetic acid, Carbamimidoylacetic acid, 3-Nitropropanoic acid
| Molecular Formula | C3H6N2O2 |
|---|---|
| Molecular Weight | 102.04 g/mol |
| LogP | -0.60293 |
| Topological Polar Surface Area | 87.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.04293 |
| Heavy Atoms | 7 |
| Complexity | 87.10803 |
Chemical Identifiers
| CAS Number | 170749-59-4 |
|---|---|
| SMILES | C(C(=N)N)C(=O)O |
Product Overview
Carbamimidoyl-acetic acid (CAS 170749-59-4), with molecular formula C3H6N2O2 and molecular weight 102.04 g/mol. IUPAC: 3-amino-3-iminopropanoic acid.
Chemical Property Profile of Carbamimidoyl-acetic acid
Property Insights of Carbamimidoyl-acetic acid
The XLogP value of -0.60293 indicates that Carbamimidoyl-acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamimidoyl-acetic acid. Following Lipinski's Rule of Five, Carbamimidoyl-acetic acid has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamimidoyl-acetic acid?
The CAS number of Carbamimidoyl-acetic acid is 170749-59-4.
What is the molecular formula of Carbamimidoyl-acetic acid?
The molecular formula of Carbamimidoyl-acetic acid is C3H6N2O2.
What is the molecular weight of Carbamimidoyl-acetic acid?
The molecular weight of Carbamimidoyl-acetic acid is 102.04 g/mol.
Where can I buy Carbamimidoyl-acetic acid?
You can request a quote for Carbamimidoyl-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamimidoyl-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Carbamimidoyl-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.