环戊-1-烯-1-乙腈
TL;DR: 环戊-1-烯-1-乙腈 (CAS 22734-04-9) is a chemical compound with molecular formula C7H9N and molecular weight 107.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环戊-1-烯-1-乙腈
2-(cyclopenten-1-yl)acetonitrile
Also Known As: 1-Cyclopentenylacetonitrile, 2-(cyclopent-1-en-1-yl)acetonitrile, 1-(Cyanomethyl)cyclopentene, 1-Cyclopenteneacetonitrile, 2-(cyclopenten-1-yl)acetonitrile
| Molecular Formula | C7H9N |
|---|---|
| Molecular Weight | 107.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 107.0735 |
| Heavy Atoms | 8 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 22734-04-9 |
|---|---|
| SMILES | C1CC=C(C1)CC#N |
| InChIKey | LEWVRAMNXUWSFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环戊-1-烯-1-乙腈 (CAS 22734-04-9), with molecular formula C7H9N and molecular weight 107.07 g/mol. IUPAC: 2-(cyclopenten-1-yl)acetonitrile.
Chemical Property Profile of 环戊-1-烯-1-乙腈
Property Insights of 环戊-1-烯-1-乙腈
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 环戊-1-烯-1-乙腈. With a topological polar surface area (TPSA) of 23.8 Ų, 环戊-1-烯-1-乙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环戊-1-烯-1-乙腈 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 环戊-1-烯-1-乙腈?
The CAS number of 环戊-1-烯-1-乙腈 is 22734-04-9.
What is the molecular formula of 环戊-1-烯-1-乙腈?
The molecular formula of 环戊-1-烯-1-乙腈 is C7H9N.
What is the molecular weight of 环戊-1-烯-1-乙腈?
The molecular weight of 环戊-1-烯-1-乙腈 is 107.07 g/mol.
Where can I buy 环戊-1-烯-1-乙腈?
You can request a quote for 环戊-1-烯-1-乙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环戊-1-烯-1-乙腈?
Yes, KEHONG BIO provides custom synthesis services for 环戊-1-烯-1-乙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.