3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile
TL;DR: 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile (CAS 4360-48-9) is a chemical compound with molecular formula C10H9NO2 and molecular weight 175.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
Also Known As: 3-(4-Hydroxy-3-methoxyphenyl)-2-propenenitrile, 3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
| Molecular Formula | C10H9NO2 |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 1.93758 |
| Topological Polar Surface Area | 53.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.06332 |
| Heavy Atoms | 13 |
| Complexity | 363.67776 |
Chemical Identifiers
| CAS Number | 4360-48-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=CC#N)O |
Product Overview
3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile (CAS 4360-48-9), with molecular formula C10H9NO2 and molecular weight 175.06 g/mol. IUPAC: 3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile
Property Insights of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile
The XLogP value of 1.93758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile. With a topological polar surface area (TPSA) of 53.25 Ų, 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile has 1 hydrogen bond donor(s) and 3 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 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The CAS number of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile is 4360-48-9.
What is the molecular formula of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The molecular formula of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile is C10H9NO2.
What is the molecular weight of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The molecular weight of 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile is 175.06 g/mol.
Where can I buy 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile?
You can request a quote for 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Hydroxy-3-methoxyphenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.