肉桂基氯
TL;DR: 肉桂基氯 (CAS 2687-12-9) is a chemical compound with molecular formula C9H9Cl and molecular weight 152.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
肉桂基氯
3-chloroprop-1-enylbenzene
Also Known As: Cinnamyl chloride, Cinnamylchloride, Chloromethylstyrene, (Chloromethyl)styrene, Benzene, (3-chloro-1-propenyl)-
| Molecular Formula | C9H9Cl |
|---|---|
| Molecular Weight | 152.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.03928 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 2687-12-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CCCl |
| InChIKey | IWTYTFSSTWXZFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
肉桂基氯 (CAS 2687-12-9), with molecular formula C9H9Cl and molecular weight 152.04 g/mol. IUPAC: 3-chloroprop-1-enylbenzene.
Chemical Property Profile of 肉桂基氯
Property Insights of 肉桂基氯
The XLogP value of 3.2 indicates that 肉桂基氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 肉桂基氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 肉桂基氯 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 肉桂基氯?
The CAS number of 肉桂基氯 is 2687-12-9.
What is the molecular formula of 肉桂基氯?
The molecular formula of 肉桂基氯 is C9H9Cl.
What is the molecular weight of 肉桂基氯?
The molecular weight of 肉桂基氯 is 152.04 g/mol.
Where can I buy 肉桂基氯?
You can request a quote for 肉桂基氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 肉桂基氯?
Yes, KEHONG BIO provides custom synthesis services for 肉桂基氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.