Acrylophenone, 2,2',5'-trimethyl-
TL;DR: Acrylophenone, 2,2',5'-trimethyl- (CAS 16205-96-2) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dimethylphenyl)-2-methylprop-2-en-1-one
Also Known As: Acrylophenone, 2,2',5'-trimethyl-, 1-(2,5-dimethylphenyl)-2-methylprop-2-en-1-one, 2,5-dimethyl-1-methacryloylbenzene, alpha,2 ,5 -Trimethylacrylophenone, 1-(2,5-Dimethyl-phenyl)-2-methyl-propenone
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 16205-96-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C(=O)C(=C)C |
| InChIKey | TVKUSGOSSOMUIR-UHFFFAOYSA-N |
Product Overview
Acrylophenone, 2,2',5'-trimethyl- (CAS 16205-96-2), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 1-(2,5-dimethylphenyl)-2-methylprop-2-en-1-one.
Chemical Property Profile of Acrylophenone, 2,2',5'-trimethyl-
Property Insights of Acrylophenone, 2,2',5'-trimethyl-
The XLogP value of 3.3 indicates that Acrylophenone, 2,2',5'-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Acrylophenone, 2,2',5'-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acrylophenone, 2,2',5'-trimethyl- 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 Acrylophenone, 2,2',5'-trimethyl-?
The CAS number of Acrylophenone, 2,2',5'-trimethyl- is 16205-96-2.
What is the molecular formula of Acrylophenone, 2,2',5'-trimethyl-?
The molecular formula of Acrylophenone, 2,2',5'-trimethyl- is C12H14O.
What is the molecular weight of Acrylophenone, 2,2',5'-trimethyl-?
The molecular weight of Acrylophenone, 2,2',5'-trimethyl- is 174.10 g/mol.
Where can I buy Acrylophenone, 2,2',5'-trimethyl-?
You can request a quote for Acrylophenone, 2,2',5'-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acrylophenone, 2,2',5'-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Acrylophenone, 2,2',5'-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.