alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride
TL;DR: alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride (CAS 61147-36-2) is a chemical compound with molecular formula C14H19ClO and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-methylpropyl)phenyl]butanoyl chloride
Also Known As: EINECS 262-625-7, alpha-ethyl-4- benzeneacetylchloride, alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride, 2-[4-(2-methylpropyl)phenyl]butanoyl chloride, 2-(4-isobutylphenyl)butyric chloride
| Molecular Formula | C14H19ClO |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 4.1441 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.11244 |
| Heavy Atoms | 16 |
| Complexity | 340.2579 |
Chemical Identifiers
| CAS Number | 61147-36-2 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)CC(C)C)C(=O)Cl |
Product Overview
alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride (CAS 61147-36-2), with molecular formula C14H19ClO and molecular weight 238.11 g/mol. IUPAC: 2-[4-(2-methylpropyl)phenyl]butanoyl chloride.
Chemical Property Profile of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride
Property Insights of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride
The XLogP value of 4.1441 indicates that alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride has 0 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 alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride?
The CAS number of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride is 61147-36-2.
What is the molecular formula of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride?
The molecular formula of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride is C14H19ClO.
What is the molecular weight of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride?
The molecular weight of alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride is 238.11 g/mol.
Where can I buy alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride?
You can request a quote for alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for alpha-Ethyl-4-(2-methylpropyl)benzeneacetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.