1,2-Dimethylcyclohexane, (1S,2S)-
TL;DR: 1,2-Dimethylcyclohexane, (1S,2S)- (CAS 802-43-7) is a chemical compound with molecular formula C8H16 and molecular weight 112.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1S,2S)-1,2-dimethylcyclohexane
Also Known As: trans-1,2-Dimethylcyclohexane, (1s,2s)-1,2-dimethylcyclohexane, 1,trans-2-Dimethylcyclohexane, trans-1,2-dimethylcyclohexan, 1,2-Dimethylcyclohexane, (1S,2S)-
| Molecular Formula | C8H16 |
|---|---|
| Molecular Weight | 112.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.1252 |
| Heavy Atoms | 8 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 802-43-7 |
|---|---|
| SMILES | C[C@H]1CCCC[C@@H]1C |
| InChIKey | KVZJLSYJROEPSQ-YUMQZZPRSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dimethylcyclohexane, (1S,2S)- (CAS 802-43-7), with molecular formula C8H16 and molecular weight 112.13 g/mol. IUPAC: trans-(1S,2S)-1,2-dimethylcyclohexane.
Chemical Property Profile of 1,2-Dimethylcyclohexane, (1S,2S)-
Property Insights of 1,2-Dimethylcyclohexane, (1S,2S)-
The XLogP value of 3.8 indicates that 1,2-Dimethylcyclohexane, (1S,2S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Dimethylcyclohexane, (1S,2S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dimethylcyclohexane, (1S,2S)- 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 1,2-Dimethylcyclohexane, (1S,2S)-?
The CAS number of 1,2-Dimethylcyclohexane, (1S,2S)- is 802-43-7.
What is the molecular formula of 1,2-Dimethylcyclohexane, (1S,2S)-?
The molecular formula of 1,2-Dimethylcyclohexane, (1S,2S)- is C8H16.
What is the molecular weight of 1,2-Dimethylcyclohexane, (1S,2S)-?
The molecular weight of 1,2-Dimethylcyclohexane, (1S,2S)- is 112.13 g/mol.
Where can I buy 1,2-Dimethylcyclohexane, (1S,2S)-?
You can request a quote for 1,2-Dimethylcyclohexane, (1S,2S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethylcyclohexane, (1S,2S)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethylcyclohexane, (1S,2S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.