3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene
TL;DR: 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene (CAS 29304-70-9) is a chemical compound with molecular formula C9H12 and molecular weight 120.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-6-methylidenecyclohexa-1,4-diene
Also Known As: 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene, 3,3-dimethyl-6-methylidenecyclohexa-1,4-diene, 3,3-dimethyl-6-methylene-1,4-cyclohexadiene, 1-Methylene-4,4-dimethyl-2,5-cyclohexadiene, 1,4-Cyclohexadiene, 3,3-dimethyl-6-methylene-
| Molecular Formula | C9H12 |
|---|---|
| Molecular Weight | 120.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 120.0939 |
| Heavy Atoms | 9 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 29304-70-9 |
|---|---|
| SMILES | CC1(C=CC(=C)C=C1)C |
| InChIKey | MMVWZLGNNGNFGT-UHFFFAOYSA-N |
Product Overview
3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene (CAS 29304-70-9), with molecular formula C9H12 and molecular weight 120.09 g/mol. IUPAC: 3,3-dimethyl-6-methylidenecyclohexa-1,4-diene.
Chemical Property Profile of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene
Property Insights of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene
The XLogP value of 3.1 indicates that 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene 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 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene?
The CAS number of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene is 29304-70-9.
What is the molecular formula of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene?
The molecular formula of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene is C9H12.
What is the molecular weight of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene?
The molecular weight of 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene is 120.09 g/mol.
Where can I buy 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene?
You can request a quote for 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-6-methylidene-1,4-cyclohexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.