![[(Cyclopenta-1,3-dien-1-yl)methyl]benzene structure](/static/products/692/69248-36-8.png)
[(Cyclopenta-1,3-dien-1-yl)methyl]benzene
TL;DR: [(Cyclopenta-1,3-dien-1-yl)methyl]benzene (CAS 69248-36-8) is a chemical compound with molecular formula C12H12 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopenta-1,3-dien-1-ylmethylbenzene
Also Known As: 1-benzylcyclopentadiene, 1-Benzyl-1,3-cyclopentadiene, Benzene, (cyclopentadienylmethyl)-, (1,3-Cyclopentadienylmethyl)benzene, 1-cyclopenta-1,3-dienylmethylbenzene
| Molecular Formula | C12H12 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.0939 |
| Heavy Atoms | 12 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 69248-36-8 |
|---|---|
| SMILES | C1C=CC=C1CC2=CC=CC=C2 |
| InChIKey | YOTNIZSDGKKMGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[(Cyclopenta-1,3-dien-1-yl)methyl]benzene (CAS 69248-36-8), with molecular formula C12H12 and molecular weight 156.09 g/mol. IUPAC: cyclopenta-1,3-dien-1-ylmethylbenzene.
Chemical Property Profile of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene
Property Insights of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene
The XLogP value of 3.3 indicates that [(Cyclopenta-1,3-dien-1-yl)methyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, [(Cyclopenta-1,3-dien-1-yl)methyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(Cyclopenta-1,3-dien-1-yl)methyl]benzene 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 [(Cyclopenta-1,3-dien-1-yl)methyl]benzene?
The CAS number of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene is 69248-36-8.
What is the molecular formula of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene?
The molecular formula of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene is C12H12.
What is the molecular weight of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene?
The molecular weight of [(Cyclopenta-1,3-dien-1-yl)methyl]benzene is 156.09 g/mol.
Where can I buy [(Cyclopenta-1,3-dien-1-yl)methyl]benzene?
You can request a quote for [(Cyclopenta-1,3-dien-1-yl)methyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Cyclopenta-1,3-dien-1-yl)methyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for [(Cyclopenta-1,3-dien-1-yl)methyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.