1,2-Dimethylcyclopentadiene
TL;DR: 1,2-Dimethylcyclopentadiene (CAS 119445-91-9) is a chemical compound with molecular formula C7H10 and molecular weight 94.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethylcyclopenta-1,3-diene
Also Known As: 1,2-Dimethylcyclopentadiene, dimethylcyclopentadiene, 1,2-dimethylcyclopenta-1,3-diene, 1,3-Cyclopentadiene, dimethyl-, 1,3-Cyclopentadiene,dimethyl
| Molecular Formula | C7H10 |
|---|---|
| Molecular Weight | 94.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 94.07825 |
| Heavy Atoms | 7 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 119445-91-9 |
|---|---|
| SMILES | CC1=C(C=CC1)C |
| InChIKey | RYILSJIMFKKICJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dimethylcyclopentadiene (CAS 119445-91-9), with molecular formula C7H10 and molecular weight 94.08 g/mol. IUPAC: 1,2-dimethylcyclopenta-1,3-diene.
Chemical Property Profile of 1,2-Dimethylcyclopentadiene
Property Insights of 1,2-Dimethylcyclopentadiene
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethylcyclopentadiene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Dimethylcyclopentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dimethylcyclopentadiene 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-Dimethylcyclopentadiene?
The CAS number of 1,2-Dimethylcyclopentadiene is 119445-91-9.
What is the molecular formula of 1,2-Dimethylcyclopentadiene?
The molecular formula of 1,2-Dimethylcyclopentadiene is C7H10.
What is the molecular weight of 1,2-Dimethylcyclopentadiene?
The molecular weight of 1,2-Dimethylcyclopentadiene is 94.08 g/mol.
Where can I buy 1,2-Dimethylcyclopentadiene?
You can request a quote for 1,2-Dimethylcyclopentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethylcyclopentadiene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethylcyclopentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.