3-(2-亚乙基肼基)丙腈
TL;DR: 3-(2-亚乙基肼基)丙腈 (CAS 42066-48-8) is a chemical compound with molecular formula C5H9N3 and molecular weight 111.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-亚乙基肼基)丙腈
3-(2-ethylidenehydrazinyl)propanenitrile
Also Known As: 3-(2-ethylidenehydrazinyl)propanenitrile, 3-[(2E)-2-ethylidenehydrazinyl]propanenitrile
| Molecular Formula | C5H9N3 |
|---|---|
| Molecular Weight | 111.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 48.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 111.07965 |
| Heavy Atoms | 8 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 42066-48-8 |
|---|---|
| SMILES | CC=NNCCC#N |
| InChIKey | ILLSCQWNSZMADV-UHFFFAOYSA-N |
Product Overview
3-(2-亚乙基肼基)丙腈 (CAS 42066-48-8), with molecular formula C5H9N3 and molecular weight 111.08 g/mol. IUPAC: 3-(2-ethylidenehydrazinyl)propanenitrile.
Chemical Property Profile of 3-(2-亚乙基肼基)丙腈
Property Insights of 3-(2-亚乙基肼基)丙腈
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-亚乙基肼基)丙腈. With a topological polar surface area (TPSA) of 48.2 Ų, 3-(2-亚乙基肼基)丙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-亚乙基肼基)丙腈 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 3-(2-亚乙基肼基)丙腈?
The CAS number of 3-(2-亚乙基肼基)丙腈 is 42066-48-8.
What is the molecular formula of 3-(2-亚乙基肼基)丙腈?
The molecular formula of 3-(2-亚乙基肼基)丙腈 is C5H9N3.
What is the molecular weight of 3-(2-亚乙基肼基)丙腈?
The molecular weight of 3-(2-亚乙基肼基)丙腈 is 111.08 g/mol.
Where can I buy 3-(2-亚乙基肼基)丙腈?
You can request a quote for 3-(2-亚乙基肼基)丙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-亚乙基肼基)丙腈?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-亚乙基肼基)丙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.