Α-甲基苯乙烯
TL;DR: Α-甲基苯乙烯 (CAS 98-83-9) is a chemical compound with molecular formula C9H10 and molecular weight 118.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Α-甲基苯乙烯
prop-1-en-2-ylbenzene
Also Known As: alpha-Methylstyrene, 2-Phenylpropene, 2-Phenyl-1-propene, Isopropenylbenzene, 2-Phenylpropylene
| Molecular Formula | C9H10 |
|---|---|
| Molecular Weight | 118.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 118.07825 |
| Heavy Atoms | 9 |
| Complexity | 96.0 |
| Melting Point | -22.8 °C |
| Boiling Point | 165.4 °C at 760 mmHg |
| Density | 0.91 at 20.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Flash Point | 53.9 °C |
| Vapor Pressure | 1.9 mmHg at 20.0 °C ; 5 mmHg at 33.9 °C |
| Refractive Index | 1.5386 @ 20 °C |
Chemical Identifiers
| CAS Number | 98-83-9 |
|---|---|
| SMILES | CC(=C)C1=CC=CC=C1 |
| InChIKey | XYLMUPLGERFSHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Α-甲基苯乙烯 (CAS 98-83-9), with molecular formula C9H10 and molecular weight 118.08 g/mol. IUPAC: prop-1-en-2-ylbenzene.
Chemical Property Profile of Α-甲基苯乙烯
Property Insights of Α-甲基苯乙烯
The XLogP value of 3.5 indicates that Α-甲基苯乙烯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Α-甲基苯乙烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Α-甲基苯乙烯 has 0 hydrogen bond donor(s) and 0 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 Α-甲基苯乙烯?
The CAS number of Α-甲基苯乙烯 is 98-83-9.
What is the molecular formula of Α-甲基苯乙烯?
The molecular formula of Α-甲基苯乙烯 is C9H10.
What is the molecular weight of Α-甲基苯乙烯?
The molecular weight of Α-甲基苯乙烯 is 118.08 g/mol.
Where can I buy Α-甲基苯乙烯?
You can request a quote for Α-甲基苯乙烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Α-甲基苯乙烯?
Yes, KEHONG BIO provides custom synthesis services for Α-甲基苯乙烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.