N-亚硝基甲基-2-氯乙胺
TL;DR: N-亚硝基甲基-2-氯乙胺 (CAS 16339-16-5) is a chemical compound with molecular formula C3H7ClN2O and molecular weight 122.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-亚硝基甲基-2-氯乙胺
N-(2-chloroethyl)-N-methylnitrous amide
Also Known As: N-Nitrosomethyl-2-chloroethylamine, N-(2-chloroethyl)-N-methylnitrous amide, Methyl-2-chloraethylnitrosamin, 2-Chloro-N-methyl-N-nitrosoethylamine, Methyl(2-chloroethyl)nitrosamine
| Molecular Formula | C3H7ClN2O |
|---|---|
| Molecular Weight | 122.02 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 122.02469 |
| Heavy Atoms | 7 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 16339-16-5 |
|---|---|
| SMILES | CN(CCCl)N=O |
| InChIKey | JTJQWOJKHHOSMK-UHFFFAOYSA-N |
Product Overview
N-亚硝基甲基-2-氯乙胺 (CAS 16339-16-5), with molecular formula C3H7ClN2O and molecular weight 122.02 g/mol. IUPAC: N-(2-chloroethyl)-N-methylnitrous amide.
Chemical Property Profile of N-亚硝基甲基-2-氯乙胺
Property Insights of N-亚硝基甲基-2-氯乙胺
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-亚硝基甲基-2-氯乙胺. With a topological polar surface area (TPSA) of 32.7 Ų, N-亚硝基甲基-2-氯乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-亚硝基甲基-2-氯乙胺 has 0 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-亚硝基甲基-2-氯乙胺?
The CAS number of N-亚硝基甲基-2-氯乙胺 is 16339-16-5.
What is the molecular formula of N-亚硝基甲基-2-氯乙胺?
The molecular formula of N-亚硝基甲基-2-氯乙胺 is C3H7ClN2O.
What is the molecular weight of N-亚硝基甲基-2-氯乙胺?
The molecular weight of N-亚硝基甲基-2-氯乙胺 is 122.02 g/mol.
Where can I buy N-亚硝基甲基-2-氯乙胺?
You can request a quote for N-亚硝基甲基-2-氯乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-亚硝基甲基-2-氯乙胺?
Yes, KEHONG BIO provides custom synthesis services for N-亚硝基甲基-2-氯乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.