N-Cyano-N',N''-bis(hydroxymethyl)guanidine
TL;DR: N-Cyano-N',N''-bis(hydroxymethyl)guanidine (CAS 40074-04-2) is a chemical compound with molecular formula C4H8N4O2 and molecular weight 144.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-2,3-bis(hydroxymethyl)guanidine
Also Known As: 1-cyano-2,3-bis(hydroxymethyl)guanidine, N-Cyano-N',N''-bis(hydroxymethyl)guanidine, N-Cyan-N',N''-bis-hydroxymethyl-guanidin, 254-782-5, EINECS 254-782-5
| Molecular Formula | C4H8N4O2 |
|---|---|
| Molecular Weight | 144.06 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 144.06473 |
| Heavy Atoms | 10 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 40074-04-2 |
|---|---|
| SMILES | C(NC(=NCO)NC#N)O |
| InChIKey | IPGBSGQYXVGOAA-UHFFFAOYSA-N |
Product Overview
N-Cyano-N',N''-bis(hydroxymethyl)guanidine (CAS 40074-04-2), with molecular formula C4H8N4O2 and molecular weight 144.06 g/mol. IUPAC: 1-cyano-2,3-bis(hydroxymethyl)guanidine.
Chemical Property Profile of N-Cyano-N',N''-bis(hydroxymethyl)guanidine
Property Insights of N-Cyano-N',N''-bis(hydroxymethyl)guanidine
The XLogP value of -1.6 indicates that N-Cyano-N',N''-bis(hydroxymethyl)guanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cyano-N',N''-bis(hydroxymethyl)guanidine. Following Lipinski's Rule of Five, N-Cyano-N',N''-bis(hydroxymethyl)guanidine has 4 hydrogen bond donor(s) and 4 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-Cyano-N',N''-bis(hydroxymethyl)guanidine?
The CAS number of N-Cyano-N',N''-bis(hydroxymethyl)guanidine is 40074-04-2.
What is the molecular formula of N-Cyano-N',N''-bis(hydroxymethyl)guanidine?
The molecular formula of N-Cyano-N',N''-bis(hydroxymethyl)guanidine is C4H8N4O2.
What is the molecular weight of N-Cyano-N',N''-bis(hydroxymethyl)guanidine?
The molecular weight of N-Cyano-N',N''-bis(hydroxymethyl)guanidine is 144.06 g/mol.
Where can I buy N-Cyano-N',N''-bis(hydroxymethyl)guanidine?
You can request a quote for N-Cyano-N',N''-bis(hydroxymethyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyano-N',N''-bis(hydroxymethyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-Cyano-N',N''-bis(hydroxymethyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.