甲基环庚烷
TL;DR: 甲基环庚烷 (CAS 4126-78-7) 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.
甲基环庚烷
methylcycloheptane
Also Known As: METHYLCYCLOHEPTANE, Cycloheptane, methyl-, N-Aminorhodanine, methyl cycloheptane, methyl-cycloheptane
| Molecular Formula | C8H16 |
|---|---|
| Molecular Weight | 112.13 g/mol |
| LogP | 4.2 |
| 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 | 49.0 |
Chemical Identifiers
| CAS Number | 4126-78-7 |
|---|---|
| SMILES | CC1CCCCCC1 |
| InChIKey | GYNNXHKOJHMOHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基环庚烷 (CAS 4126-78-7), with molecular formula C8H16 and molecular weight 112.13 g/mol. IUPAC: methylcycloheptane.
Chemical Property Profile of 甲基环庚烷
Property Insights of 甲基环庚烷
The XLogP value of 4.2 indicates that 甲基环庚烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 甲基环庚烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基环庚烷 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 甲基环庚烷?
The CAS number of 甲基环庚烷 is 4126-78-7.
What is the molecular formula of 甲基环庚烷?
The molecular formula of 甲基环庚烷 is C8H16.
What is the molecular weight of 甲基环庚烷?
The molecular weight of 甲基环庚烷 is 112.13 g/mol.
Where can I buy 甲基环庚烷?
You can request a quote for 甲基环庚烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基环庚烷?
Yes, KEHONG BIO provides custom synthesis services for 甲基环庚烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.