Cyclopentylmalononitrile
TL;DR: Cyclopentylmalononitrile (CAS 30963-90-7) is a chemical compound with molecular formula C8H10N2 and molecular weight 134.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclopentylpropanedinitrile
Also Known As: Cyclopentylmalononitrile, Cyclopentanemalononitrile, 2-cyclopentylpropanedinitrile, Cyclopentylpropanedinitrile, 2-Cyclopentylmalononitrile
| Molecular Formula | C8H10N2 |
|---|---|
| Molecular Weight | 134.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 134.0844 |
| Heavy Atoms | 10 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 30963-90-7 |
|---|---|
| SMILES | C1CCC(C1)C(C#N)C#N |
| InChIKey | QPZTZAUCZLSRJQ-UHFFFAOYSA-N |
Product Overview
Cyclopentylmalononitrile (CAS 30963-90-7), with molecular formula C8H10N2 and molecular weight 134.08 g/mol. IUPAC: 2-cyclopentylpropanedinitrile.
Chemical Property Profile of Cyclopentylmalononitrile
Property Insights of Cyclopentylmalononitrile
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentylmalononitrile. With a topological polar surface area (TPSA) of 47.6 Ų, Cyclopentylmalononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentylmalononitrile has 0 hydrogen bond donor(s) and 2 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 Cyclopentylmalononitrile?
The CAS number of Cyclopentylmalononitrile is 30963-90-7.
What is the molecular formula of Cyclopentylmalononitrile?
The molecular formula of Cyclopentylmalononitrile is C8H10N2.
What is the molecular weight of Cyclopentylmalononitrile?
The molecular weight of Cyclopentylmalononitrile is 134.08 g/mol.
Where can I buy Cyclopentylmalononitrile?
You can request a quote for Cyclopentylmalononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentylmalononitrile?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentylmalononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.