Phenol, 2-(3-chloro-2-propenyl)-4-methyl-
TL;DR: Phenol, 2-(3-chloro-2-propenyl)-4-methyl- (CAS 102117-74-8) is a chemical compound with molecular formula C10H11ClO and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloroprop-2-enyl)-4-methylphenol
Also Known As: Phenol, 2-(3-chloro-2-propenyl)-4-methyl-, 2-(3-chloroprop-2-enyl)-4-methylphenol, 4-methyl-2-(3-chloro-2-propenyl)phenol, 2-(3-CHLOROPROP-2-EN-1-YL)-4-METHYLPHENOL, RefChem:368983
| Molecular Formula | C10H11ClO |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.04984 |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 102117-74-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)CC=CCl |
| InChIKey | YWASPXAVAGDMAT-UHFFFAOYSA-N |
Product Overview
Phenol, 2-(3-chloro-2-propenyl)-4-methyl- (CAS 102117-74-8), with molecular formula C10H11ClO and molecular weight 182.05 g/mol. IUPAC: 2-(3-chloroprop-2-enyl)-4-methylphenol.
Chemical Property Profile of Phenol, 2-(3-chloro-2-propenyl)-4-methyl-
Property Insights of Phenol, 2-(3-chloro-2-propenyl)-4-methyl-
The XLogP value of 3.3 indicates that Phenol, 2-(3-chloro-2-propenyl)-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 2-(3-chloro-2-propenyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2-(3-chloro-2-propenyl)-4-methyl- has 1 hydrogen bond donor(s) and 1 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 Phenol, 2-(3-chloro-2-propenyl)-4-methyl-?
The CAS number of Phenol, 2-(3-chloro-2-propenyl)-4-methyl- is 102117-74-8.
What is the molecular formula of Phenol, 2-(3-chloro-2-propenyl)-4-methyl-?
The molecular formula of Phenol, 2-(3-chloro-2-propenyl)-4-methyl- is C10H11ClO.
What is the molecular weight of Phenol, 2-(3-chloro-2-propenyl)-4-methyl-?
The molecular weight of Phenol, 2-(3-chloro-2-propenyl)-4-methyl- is 182.05 g/mol.
Where can I buy Phenol, 2-(3-chloro-2-propenyl)-4-methyl-?
You can request a quote for Phenol, 2-(3-chloro-2-propenyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2-(3-chloro-2-propenyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2-(3-chloro-2-propenyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.