1-Penten-3-one, 4-methyl-1-phenyl-
TL;DR: 1-Penten-3-one, 4-methyl-1-phenyl- (CAS 10596-48-2) 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.
(E)-4-methyl-1-phenylpent-1-en-3-one
Also Known As: Isopropyl styryl ketone, Isopropylstyryl ketone, 4-Methyl-1-phenyl-1-penten-3-one, 4-Methyl-1-phenylpent-1-en-3-one, 1-PENTEN-3-ONE, 4-METHYL-1-PHENYL-
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 2.9249 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 296.16034 |
Chemical Identifiers
| CAS Number | 10596-48-2 |
|---|---|
| SMILES | CC(C)C(=O)/C=C/C1=CC=CC=C1 |
Product Overview
1-Penten-3-one, 4-methyl-1-phenyl- (CAS 10596-48-2), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: (E)-4-methyl-1-phenylpent-1-en-3-one.
Chemical Property Profile of 1-Penten-3-one, 4-methyl-1-phenyl-
Property Insights of 1-Penten-3-one, 4-methyl-1-phenyl-
The XLogP value of 2.9249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Penten-3-one, 4-methyl-1-phenyl-. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Penten-3-one, 4-methyl-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Penten-3-one, 4-methyl-1-phenyl- 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 1-Penten-3-one, 4-methyl-1-phenyl-?
The CAS number of 1-Penten-3-one, 4-methyl-1-phenyl- is 10596-48-2.
What is the molecular formula of 1-Penten-3-one, 4-methyl-1-phenyl-?
The molecular formula of 1-Penten-3-one, 4-methyl-1-phenyl- is C12H14O.
What is the molecular weight of 1-Penten-3-one, 4-methyl-1-phenyl-?
The molecular weight of 1-Penten-3-one, 4-methyl-1-phenyl- is 174.10 g/mol.
Where can I buy 1-Penten-3-one, 4-methyl-1-phenyl-?
You can request a quote for 1-Penten-3-one, 4-methyl-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Penten-3-one, 4-methyl-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Penten-3-one, 4-methyl-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.