Beta-Phellandrene
TL;DR: Beta-Phellandrene (CAS 555-10-2) 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.
3-methylidene-6-propan-2-ylcyclohexene
Also Known As: BETA-PHELLANDRENE, A-phellandrene, 2-p-Menthadiene, b-phellandrene, p-Mentha-1(7),2-diene
| Molecular Formula | C10H16 |
|---|---|
| Molecular Weight | 136.13 g/mol |
| LogP | 3.4 |
| 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 | 151.0 |
| Boiling Point | 171.00 to 174.00 °C. @ 760.00 mm Hg |
| Flash Point | 48.9 °C. |
| Vapor Pressure | 1.59 [mmHg] |
Chemical Identifiers
| CAS Number | 555-10-2 |
|---|---|
| SMILES | CC(C)C1CCC(=C)C=C1 |
| InChIKey | LFJQCDVYDGGFCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Beta-Phellandrene (CAS 555-10-2), with molecular formula C10H16 and molecular weight 136.13 g/mol. IUPAC: 3-methylidene-6-propan-2-ylcyclohexene.
Chemical Property Profile of Beta-Phellandrene
Property Insights of Beta-Phellandrene
The XLogP value of 3.4 indicates that Beta-Phellandrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Beta-Phellandrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Beta-Phellandrene 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 Beta-Phellandrene?
The CAS number of Beta-Phellandrene is 555-10-2.
What is the molecular formula of Beta-Phellandrene?
The molecular formula of Beta-Phellandrene is C10H16.
What is the molecular weight of Beta-Phellandrene?
The molecular weight of Beta-Phellandrene is 136.13 g/mol.
Where can I buy Beta-Phellandrene?
You can request a quote for Beta-Phellandrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Beta-Phellandrene?
Yes, KEHONG BIO provides custom synthesis services for Beta-Phellandrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.