(E)-2-呋喃丙烯腈
TL;DR: (E)-2-呋喃丙烯腈 (CAS 7187-01-1) is a chemical compound with molecular formula C7H5NO and molecular weight 119.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-呋喃丙烯腈
3-(furan-2-yl)prop-2-enenitrile
Also Known As: 2-Furanacrylonitrile, furanacrylonitrile, 2-Furanacrylonitrile, (E)-, 3-(furan-2-yl)prop-2-enenitrile, 3-(2-Furyl)acrylonitrile
| Molecular Formula | C7H5NO |
|---|---|
| Molecular Weight | 119.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 119.03712 |
| Heavy Atoms | 9 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 7187-01-1 |
|---|---|
| SMILES | C1=COC(=C1)C=CC#N |
| InChIKey | ZHKAQNFBQHPERX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(E)-2-呋喃丙烯腈 (CAS 7187-01-1), with molecular formula C7H5NO and molecular weight 119.04 g/mol. IUPAC: 3-(furan-2-yl)prop-2-enenitrile.
Chemical Property Profile of (E)-2-呋喃丙烯腈
Property Insights of (E)-2-呋喃丙烯腈
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-呋喃丙烯腈. With a topological polar surface area (TPSA) of 36.9 Ų, (E)-2-呋喃丙烯腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-呋喃丙烯腈 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 (E)-2-呋喃丙烯腈?
The CAS number of (E)-2-呋喃丙烯腈 is 7187-01-1.
What is the molecular formula of (E)-2-呋喃丙烯腈?
The molecular formula of (E)-2-呋喃丙烯腈 is C7H5NO.
What is the molecular weight of (E)-2-呋喃丙烯腈?
The molecular weight of (E)-2-呋喃丙烯腈 is 119.04 g/mol.
Where can I buy (E)-2-呋喃丙烯腈?
You can request a quote for (E)-2-呋喃丙烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-呋喃丙烯腈?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-呋喃丙烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.