trans-4-(1-Methylethyl)-2-cyclohexen-1-ol
TL;DR: trans-4-(1-Methylethyl)-2-cyclohexen-1-ol (CAS 33531-22-5) is a chemical compound with molecular formula C9H16O and molecular weight 140.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4S)-4-propan-2-ylcyclohex-2-en-1-ol
Also Known As: (+)-trans-Cryptol, trans-4-(1-Methylethyl)-2-cyclohexen-1-ol, -4-Isopropyl-2-cyclohexen-1-ol, N-beta-hydroxyethylvindesine Sulfate, (1R,4S)-4-Isopropyl-2-cyclohexen-1-ol
| Molecular Formula | C9H16O |
|---|---|
| Molecular Weight | 140.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.12012 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 33531-22-5 |
|---|---|
| SMILES | CC(C)[C@@H]1CC[C@H](C=C1)O |
| InChIKey | CJAQNMJQZNLNHG-IUCAKERBSA-N |
Product Overview
trans-4-(1-Methylethyl)-2-cyclohexen-1-ol (CAS 33531-22-5), with molecular formula C9H16O and molecular weight 140.12 g/mol. IUPAC: (1R,4S)-4-propan-2-ylcyclohex-2-en-1-ol.
Chemical Property Profile of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol
Property Insights of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-4-(1-Methylethyl)-2-cyclohexen-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, trans-4-(1-Methylethyl)-2-cyclohexen-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-4-(1-Methylethyl)-2-cyclohexen-1-ol 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 trans-4-(1-Methylethyl)-2-cyclohexen-1-ol?
The CAS number of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol is 33531-22-5.
What is the molecular formula of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol?
The molecular formula of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol is C9H16O.
What is the molecular weight of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol?
The molecular weight of trans-4-(1-Methylethyl)-2-cyclohexen-1-ol is 140.12 g/mol.
Where can I buy trans-4-(1-Methylethyl)-2-cyclohexen-1-ol?
You can request a quote for trans-4-(1-Methylethyl)-2-cyclohexen-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-4-(1-Methylethyl)-2-cyclohexen-1-ol?
Yes, KEHONG BIO provides custom synthesis services for trans-4-(1-Methylethyl)-2-cyclohexen-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.