4-Phenylbut-3-ene-1,2-diol
TL;DR: 4-Phenylbut-3-ene-1,2-diol (CAS 98184-95-3) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-phenylbut-3-ene-1,2-diol
Also Known As: 4-phenylbut-3-ene-1,2-diol, 4-Phenyl-3-butene-1,2-diol, (E)-4-phenylbut-3-ene-1,2-diol, (E)-4-Phenyl-3-butene-1,2-diol, (3E)-4-phenyl-3-butene-1,2-diol
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.053 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 241.27531 |
Chemical Identifiers
| CAS Number | 98184-95-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(CO)O |
Product Overview
4-Phenylbut-3-ene-1,2-diol (CAS 98184-95-3), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: (E)-4-phenylbut-3-ene-1,2-diol.
Chemical Property Profile of 4-Phenylbut-3-ene-1,2-diol
Property Insights of 4-Phenylbut-3-ene-1,2-diol
The XLogP value of 1.053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylbut-3-ene-1,2-diol. With a topological polar surface area (TPSA) of 40.46 Ų, 4-Phenylbut-3-ene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylbut-3-ene-1,2-diol has 2 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 4-Phenylbut-3-ene-1,2-diol?
The CAS number of 4-Phenylbut-3-ene-1,2-diol is 98184-95-3.
What is the molecular formula of 4-Phenylbut-3-ene-1,2-diol?
The molecular formula of 4-Phenylbut-3-ene-1,2-diol is C10H12O2.
What is the molecular weight of 4-Phenylbut-3-ene-1,2-diol?
The molecular weight of 4-Phenylbut-3-ene-1,2-diol is 164.08 g/mol.
Where can I buy 4-Phenylbut-3-ene-1,2-diol?
You can request a quote for 4-Phenylbut-3-ene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylbut-3-ene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylbut-3-ene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.