甲基环己烯基丁醇
TL;DR: 甲基环己烯基丁醇 (CAS 15760-18-6) is a chemical compound with molecular formula C11H20O and molecular weight 168.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基环己烯基丁醇
3-(4-methylcyclohex-3-en-1-yl)butan-1-ol
Also Known As: citrus propanol, methylcyclohexenyl butanol, CYCLOMETHYLENECITRONELLOL, 3-(4-methylcyclohex-3-en-1-yl)butan-1-ol, 3-(4-Methyl-3-cyclohexenyl)butanol
| Molecular Formula | C11H20O |
|---|---|
| Molecular Weight | 168.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.15141 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 15760-18-6 |
|---|---|
| SMILES | CC1=CCC(CC1)C(C)CCO |
| InChIKey | JTVKFAPEIBMMHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基环己烯基丁醇 (CAS 15760-18-6), with molecular formula C11H20O and molecular weight 168.15 g/mol. IUPAC: 3-(4-methylcyclohex-3-en-1-yl)butan-1-ol.
Chemical Property Profile of 甲基环己烯基丁醇
Property Insights of 甲基环己烯基丁醇
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基环己烯基丁醇. With a topological polar surface area (TPSA) of 20.2 Ų, 甲基环己烯基丁醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基环己烯基丁醇 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 甲基环己烯基丁醇?
The CAS number of 甲基环己烯基丁醇 is 15760-18-6.
What is the molecular formula of 甲基环己烯基丁醇?
The molecular formula of 甲基环己烯基丁醇 is C11H20O.
What is the molecular weight of 甲基环己烯基丁醇?
The molecular weight of 甲基环己烯基丁醇 is 168.15 g/mol.
Where can I buy 甲基环己烯基丁醇?
You can request a quote for 甲基环己烯基丁醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基环己烯基丁醇?
Yes, KEHONG BIO provides custom synthesis services for 甲基环己烯基丁醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.