萜品油烯
TL;DR: 萜品油烯 (CAS 586-62-9) 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.
萜品油烯
1-methyl-4-propan-2-ylidenecyclohexene
Also Known As: TERPINOLENE, Isoterpinene, Terpinolen, alpha-Terpinolene, Tereben
| Molecular Formula | C10H16 |
|---|---|
| Molecular Weight | 136.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.1252 |
| Heavy Atoms | 10 |
| Complexity | 178.0 |
| Melting Point | < 25 °C |
| Boiling Point | 187 °C |
| Density | 0.8632 g/cu cm at 15 °C |
| Solubility | In water, 9.5 mg/L at 25 °C |
| Flash Point | 64 °C (63.9 °C) - closed cup |
| Vapor Pressure | 0.74 [mmHg] |
| Refractive Index | 1.4883 at 20 °C |
Chemical Identifiers
| CAS Number | 586-62-9 |
|---|---|
| SMILES | CC1=CCC(=C(C)C)CC1 |
| InChIKey | MOYAFQVGZZPNRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
萜品油烯 (CAS 586-62-9), with molecular formula C10H16 and molecular weight 136.13 g/mol. IUPAC: 1-methyl-4-propan-2-ylidenecyclohexene.
Chemical Property Profile of 萜品油烯
Property Insights of 萜品油烯
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 萜品油烯. With a topological polar surface area (TPSA) of 0.0 Ų, 萜品油烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 萜品油烯 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 萜品油烯?
The CAS number of 萜品油烯 is 586-62-9.
What is the molecular formula of 萜品油烯?
The molecular formula of 萜品油烯 is C10H16.
What is the molecular weight of 萜品油烯?
The molecular weight of 萜品油烯 is 136.13 g/mol.
Where can I buy 萜品油烯?
You can request a quote for 萜品油烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 萜品油烯?
Yes, KEHONG BIO provides custom synthesis services for 萜品油烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.