(2Z)-3-chloro-4,4-dimethylpent-2-enenitrile
TL;DR: (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile (CAS 216574-58-2) is a chemical compound with molecular formula C7H10ClN and molecular weight 143.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-chloro-4,4-dimethylpent-2-enenitrile
Also Known As: 3-chloro-4,4-dimethylpent-2-enenitrile, 3-Chloro-4,4-dimethyl-pent-2-enenitrile, 3-Chloro-4,4-dimethyl-2-pentenenitrile, (Z)-3-chloro-4,4-dimethylpent-2-enenitrile, (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile
| Molecular Formula | C7H10ClN |
|---|---|
| Molecular Weight | 143.05 g/mol |
| LogP | 2.67878 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 143.05017 |
| Heavy Atoms | 9 |
| Complexity | 156.73541 |
Chemical Identifiers
| CAS Number | 216574-58-2 |
|---|---|
| SMILES | CC(C)(C)/C(=C/C#N)/Cl |
Product Overview
(2Z)-3-chloro-4,4-dimethylpent-2-enenitrile (CAS 216574-58-2), with molecular formula C7H10ClN and molecular weight 143.05 g/mol. IUPAC: (Z)-3-chloro-4,4-dimethylpent-2-enenitrile.
Chemical Property Profile of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile
Property Insights of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile
The XLogP value of 2.67878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile. With a topological polar surface area (TPSA) of 23.79 Ų, (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile 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 (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile?
The CAS number of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile is 216574-58-2.
What is the molecular formula of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile?
The molecular formula of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile is C7H10ClN.
What is the molecular weight of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile?
The molecular weight of (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile is 143.05 g/mol.
Where can I buy (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile?
You can request a quote for (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-3-chloro-4,4-dimethylpent-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.