2-Chloroacetonitrile-1-14C
TL;DR: 2-Chloroacetonitrile-1-14C (CAS 56746-52-2) is a chemical compound with molecular formula C([14C]#N)Cl and molecular weight 76.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroacetonitrile
Also Known As: 2-Chloroacetonitrile, CHLOROACETONITRILE, 2-Chloroacetonitrile-1-14C, 2-(14C)chloroacetonitrile, Acetonitrile-1-14C, 2-chloro-
| Molecular Formula | C([14C]#N)Cl |
|---|---|
| Molecular Weight | 76.99 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 76.99082 |
| Heavy Atoms | 4 |
| Complexity | 41.0 |
Chemical Identifiers
| CAS Number | 56746-52-2 |
|---|---|
| SMILES | C([14C]#N)Cl |
| InChIKey | RENMDAKOXSCIGH-HQMMCQRPSA-N |
Product Overview
2-Chloroacetonitrile-1-14C (CAS 56746-52-2), with molecular formula C([14C]#N)Cl and molecular weight 76.99 g/mol. IUPAC: 2-chloroacetonitrile.
Chemical Property Profile of 2-Chloroacetonitrile-1-14C
Property Insights of 2-Chloroacetonitrile-1-14C
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroacetonitrile-1-14C. With a topological polar surface area (TPSA) of 23.8 Ų, 2-Chloroacetonitrile-1-14C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroacetonitrile-1-14C has 0 hydrogen bond donor(s) and 1 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 2-Chloroacetonitrile-1-14C?
The CAS number of 2-Chloroacetonitrile-1-14C is 56746-52-2.
What is the molecular formula of 2-Chloroacetonitrile-1-14C?
The molecular formula of 2-Chloroacetonitrile-1-14C is C([14C]#N)Cl.
What is the molecular weight of 2-Chloroacetonitrile-1-14C?
The molecular weight of 2-Chloroacetonitrile-1-14C is 76.99 g/mol.
Where can I buy 2-Chloroacetonitrile-1-14C?
You can request a quote for 2-Chloroacetonitrile-1-14C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroacetonitrile-1-14C?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroacetonitrile-1-14C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.