1-Chloro-4-cinnamylbenzene
TL;DR: 1-Chloro-4-cinnamylbenzene (CAS 6948-68-1) is a chemical compound with molecular formula C15H13Cl and molecular weight 228.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(3-phenylprop-2-enyl)benzene
Also Known As: 1-Chloro-4-cinnamylbenzene, 1-chloro-4-(3-phenylallyl)benzene, 1-chloro-4-(3-phenylprop-2-enyl)benzene, 1-chloro-4-(3-phenylprop-2-en-1-yl)benzene
| Molecular Formula | C15H13Cl |
|---|---|
| Molecular Weight | 228.07 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.07057 |
| Heavy Atoms | 16 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 6948-68-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CCC2=CC=C(C=C2)Cl |
| InChIKey | FUXKMXILIPDZQP-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-cinnamylbenzene (CAS 6948-68-1), with molecular formula C15H13Cl and molecular weight 228.07 g/mol. IUPAC: 1-chloro-4-(3-phenylprop-2-enyl)benzene.
Chemical Property Profile of 1-Chloro-4-cinnamylbenzene
Property Insights of 1-Chloro-4-cinnamylbenzene
The XLogP value of 5.1 indicates that 1-Chloro-4-cinnamylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-4-cinnamylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-cinnamylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-4-cinnamylbenzene?
The CAS number of 1-Chloro-4-cinnamylbenzene is 6948-68-1.
What is the molecular formula of 1-Chloro-4-cinnamylbenzene?
The molecular formula of 1-Chloro-4-cinnamylbenzene is C15H13Cl.
What is the molecular weight of 1-Chloro-4-cinnamylbenzene?
The molecular weight of 1-Chloro-4-cinnamylbenzene is 228.07 g/mol.
Where can I buy 1-Chloro-4-cinnamylbenzene?
You can request a quote for 1-Chloro-4-cinnamylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-cinnamylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-cinnamylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.