Cycloheptene, 1,2-dimethyl-
TL;DR: Cycloheptene, 1,2-dimethyl- (CAS 20053-89-8) is a chemical compound with molecular formula C9H16 and molecular weight 124.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethylcycloheptene
Also Known As: Cycloheptene, 1,2-dimethyl-, 1,2-dimethylcyclohept-1-ene, 1,2-Dimethyl-1-cycloheptene, 1,2-dimethylcycloheptene, 1,2-Dimethyl-1-cycloheptene #
| Molecular Formula | C9H16 |
|---|---|
| Molecular Weight | 124.13 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 | 124.1252 |
| Heavy Atoms | 9 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 20053-89-8 |
|---|---|
| SMILES | CC1=C(CCCCC1)C |
| InChIKey | RNUMLXRVXVCOAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cycloheptene, 1,2-dimethyl- (CAS 20053-89-8), with molecular formula C9H16 and molecular weight 124.13 g/mol. IUPAC: 1,2-dimethylcycloheptene.
Chemical Property Profile of Cycloheptene, 1,2-dimethyl-
Property Insights of Cycloheptene, 1,2-dimethyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cycloheptene, 1,2-dimethyl-. With a topological polar surface area (TPSA) of 0.0 Ų, Cycloheptene, 1,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cycloheptene, 1,2-dimethyl- 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 Cycloheptene, 1,2-dimethyl-?
The CAS number of Cycloheptene, 1,2-dimethyl- is 20053-89-8.
What is the molecular formula of Cycloheptene, 1,2-dimethyl-?
The molecular formula of Cycloheptene, 1,2-dimethyl- is C9H16.
What is the molecular weight of Cycloheptene, 1,2-dimethyl-?
The molecular weight of Cycloheptene, 1,2-dimethyl- is 124.13 g/mol.
Where can I buy Cycloheptene, 1,2-dimethyl-?
You can request a quote for Cycloheptene, 1,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cycloheptene, 1,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Cycloheptene, 1,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.