(2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile
TL;DR: (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile (CAS 72030-15-0) is a chemical compound with molecular formula C13H8ClNO and molecular weight 229.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-(furan-2-yl)prop-2-enenitrile
Also Known As: Maybridge3_004900, 2-(4-chlorophenyl)-3-(2-furyl)acrylonitrile, 2-(4-chlorophenyl)-3-(furan-2-yl)prop-2-enenitrile, (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile, (E)-2-(4-chlorophenyl)-3-(furan-2-yl)prop-2-enenitrile
| Molecular Formula | C13H8ClNO |
|---|---|
| Molecular Weight | 229.03 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.02943 |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 72030-15-0 |
|---|---|
| SMILES | C1=COC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl |
| InChIKey | QRCXABRYUUSBED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile (CAS 72030-15-0), with molecular formula C13H8ClNO and molecular weight 229.03 g/mol. IUPAC: 2-(4-chlorophenyl)-3-(furan-2-yl)prop-2-enenitrile.
Chemical Property Profile of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile
Property Insights of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile
The XLogP value of 3.7 indicates that (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile 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 (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile?
The CAS number of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile is 72030-15-0.
What is the molecular formula of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile?
The molecular formula of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile is C13H8ClNO.
What is the molecular weight of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile?
The molecular weight of (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile is 229.03 g/mol.
Where can I buy (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile?
You can request a quote for (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-(4-chlorophenyl)-3-(2-furyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.