α-水芹烯
TL;DR: α-水芹烯 (CAS 99-83-2) is a chemical compound with molecular formula C10H16 and molecular weight 136.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
α-水芹烯
2-methyl-5-propan-2-ylcyclohexa-1,3-diene
Also Known As: ALPHA-PHELLANDRENE, Menthadiene, p-Mentha-1,5-diene, A-phellandrene, a-phellandrene
| Molecular Formula | C10H16 |
|---|---|
| Molecular Weight | 136.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.1252 |
| Heavy Atoms | 10 |
| Complexity | 161.0 |
| Melting Point | 249.00 °C. @ 760.00 mm Hg |
| Density | 0.845-0.855 |
| Solubility | PRACTICALLY INSOL IN WATER; SOL IN ETHER /D- & L-FORMS/ |
| Vapor Pressure | 1.4 [mmHg] |
| Refractive Index | 1.471-1.477 |
| GHS Signal | Danger |
| H-Statements | H226, H304 |
Chemical Identifiers
| CAS Number | 99-83-2 |
|---|---|
| SMILES | CC1=CCC(C=C1)C(C)C |
| InChIKey | OGLDWXZKYODSOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
α-水芹烯 (CAS 99-83-2), with molecular formula C10H16 and molecular weight 136.13 g/mol. IUPAC: 2-methyl-5-propan-2-ylcyclohexa-1,3-diene.
Chemical Property Profile of α-水芹烯
Property Insights of α-水芹烯
The XLogP value of 3.2 indicates that α-水芹烯 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-水芹烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, α-水芹烯 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-水芹烯?
The CAS number of α-水芹烯 is 99-83-2.
What is the molecular formula of α-水芹烯?
The molecular formula of α-水芹烯 is C10H16.
What is the molecular weight of α-水芹烯?
The molecular weight of α-水芹烯 is 136.13 g/mol.
Where can I buy α-水芹烯?
You can request a quote for α-水芹烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for α-水芹烯?
Yes, KEHONG BIO provides custom synthesis services for α-水芹烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.