3-苯基丙-2-烯-1-醇
TL;DR: 3-苯基丙-2-烯-1-醇 (CAS 104-54-1) is a chemical compound with molecular formula C9H10O and molecular weight 134.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-苯基丙-2-烯-1-醇
3-phenylprop-2-en-1-ol
Also Known As: cinnamyl alcohol, 3-phenylprop-2-en-1-ol, cinnamic alcohol, Phenylallyl alcohol, Styrylcarbinol
| Molecular Formula | C9H10O |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.07317 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
| Melting Point | 33 °C |
| Boiling Point | 250.00 to 258.00 °C. @ 760.00 mm Hg |
Chemical Identifiers
| CAS Number | 104-54-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CCO |
| InChIKey | OOCCDEMITAIZTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-苯基丙-2-烯-1-醇 (CAS 104-54-1), with molecular formula C9H10O and molecular weight 134.07 g/mol. IUPAC: 3-phenylprop-2-en-1-ol.
Chemical Property Profile of 3-苯基丙-2-烯-1-醇
Property Insights of 3-苯基丙-2-烯-1-醇
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-苯基丙-2-烯-1-醇. With a topological polar surface area (TPSA) of 20.2 Ų, 3-苯基丙-2-烯-1-醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-苯基丙-2-烯-1-醇 has 1 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 3-苯基丙-2-烯-1-醇?
The CAS number of 3-苯基丙-2-烯-1-醇 is 104-54-1.
What is the molecular formula of 3-苯基丙-2-烯-1-醇?
The molecular formula of 3-苯基丙-2-烯-1-醇 is C9H10O.
What is the molecular weight of 3-苯基丙-2-烯-1-醇?
The molecular weight of 3-苯基丙-2-烯-1-醇 is 134.07 g/mol.
Where can I buy 3-苯基丙-2-烯-1-醇?
You can request a quote for 3-苯基丙-2-烯-1-醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-苯基丙-2-烯-1-醇?
Yes, KEHONG BIO provides custom synthesis services for 3-苯基丙-2-烯-1-醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.