N-氰基氨基甲酸甲酯
TL;DR: N-氰基氨基甲酸甲酯 (CAS 21729-98-6) is a chemical compound with molecular formula C3H4N2O2 and molecular weight 100.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-氰基氨基甲酸甲酯
methyl N-cyanocarbamate
Also Known As: Methyl cyanocarbamate, methyl n-cyanocarbamate, carbomethoxycyanamide, METHYLCYANOCARBAMATE, Albendazole Impurity 23
| Molecular Formula | C3H4N2O2 |
|---|---|
| Molecular Weight | 100.03 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 100.027275 |
| Heavy Atoms | 7 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 21729-98-6 |
|---|---|
| SMILES | COC(=O)NC#N |
| InChIKey | ZSYJMXLJNPEAGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-氰基氨基甲酸甲酯 (CAS 21729-98-6), with molecular formula C3H4N2O2 and molecular weight 100.03 g/mol. IUPAC: methyl N-cyanocarbamate.
Chemical Property Profile of N-氰基氨基甲酸甲酯
Property Insights of N-氰基氨基甲酸甲酯
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-氰基氨基甲酸甲酯. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-氰基氨基甲酸甲酯. Following Lipinski's Rule of Five, N-氰基氨基甲酸甲酯 has 1 hydrogen bond donor(s) and 3 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 N-氰基氨基甲酸甲酯?
The CAS number of N-氰基氨基甲酸甲酯 is 21729-98-6.
What is the molecular formula of N-氰基氨基甲酸甲酯?
The molecular formula of N-氰基氨基甲酸甲酯 is C3H4N2O2.
What is the molecular weight of N-氰基氨基甲酸甲酯?
The molecular weight of N-氰基氨基甲酸甲酯 is 100.03 g/mol.
Where can I buy N-氰基氨基甲酸甲酯?
You can request a quote for N-氰基氨基甲酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-氰基氨基甲酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for N-氰基氨基甲酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.