氰基乙炔
TL;DR: 氰基乙炔 (CAS 1070-71-9) is a chemical compound with molecular formula C3HN and molecular weight 51.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氰基乙炔
prop-2-ynenitrile
Also Known As: Cyanoacetylene, 2-Propynenitrile, PROPIOLONITRILE, prop-2-ynenitrile, Propynenitrile
| Molecular Formula | C3HN |
|---|---|
| Molecular Weight | 51.01 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 | 51.0109 |
| Heavy Atoms | 4 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 1070-71-9 |
|---|---|
| SMILES | C#CC#N |
| InChIKey | LNDJVIYUJOJFSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氰基乙炔 (CAS 1070-71-9), with molecular formula C3HN and molecular weight 51.01 g/mol. IUPAC: prop-2-ynenitrile.
Chemical Property Profile of 氰基乙炔
Property Insights of 氰基乙炔
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氰基乙炔. With a topological polar surface area (TPSA) of 23.8 Ų, 氰基乙炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氰基乙炔 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 氰基乙炔?
The CAS number of 氰基乙炔 is 1070-71-9.
What is the molecular formula of 氰基乙炔?
The molecular formula of 氰基乙炔 is C3HN.
What is the molecular weight of 氰基乙炔?
The molecular weight of 氰基乙炔 is 51.01 g/mol.
Where can I buy 氰基乙炔?
You can request a quote for 氰基乙炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氰基乙炔?
Yes, KEHONG BIO provides custom synthesis services for 氰基乙炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.