(E)-6-methyl-1-phenylhept-1-en-3-one
TL;DR: (E)-6-methyl-1-phenylhept-1-en-3-one (CAS 82297-63-0) is a chemical compound with molecular formula C14H18O and molecular weight 202.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-6-methyl-1-phenylhept-1-en-3-one
Also Known As: 3-Methyl-n-butylstyrylketon, 6-methyl-1-phenyl-1-hepten-3-one, (E)-6-methyl-1-phenylhept-1-en-3-one, (Z)-6-methyl-1-phenylhept-1-en-3-one
| Molecular Formula | C14H18O |
|---|---|
| Molecular Weight | 202.14 g/mol |
| LogP | 3.7051 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 202.13577 |
| Heavy Atoms | 15 |
| Complexity | 322.45175 |
Chemical Identifiers
| CAS Number | 82297-63-0 |
|---|---|
| SMILES | CC(C)CCC(=O)/C=C/C1=CC=CC=C1 |
Product Overview
(E)-6-methyl-1-phenylhept-1-en-3-one (CAS 82297-63-0), with molecular formula C14H18O and molecular weight 202.14 g/mol. IUPAC: (E)-6-methyl-1-phenylhept-1-en-3-one.
Chemical Property Profile of (E)-6-methyl-1-phenylhept-1-en-3-one
Property Insights of (E)-6-methyl-1-phenylhept-1-en-3-one
The XLogP value of 3.7051 indicates that (E)-6-methyl-1-phenylhept-1-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, (E)-6-methyl-1-phenylhept-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-6-methyl-1-phenylhept-1-en-3-one 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 (E)-6-methyl-1-phenylhept-1-en-3-one?
The CAS number of (E)-6-methyl-1-phenylhept-1-en-3-one is 82297-63-0.
What is the molecular formula of (E)-6-methyl-1-phenylhept-1-en-3-one?
The molecular formula of (E)-6-methyl-1-phenylhept-1-en-3-one is C14H18O.
What is the molecular weight of (E)-6-methyl-1-phenylhept-1-en-3-one?
The molecular weight of (E)-6-methyl-1-phenylhept-1-en-3-one is 202.14 g/mol.
Where can I buy (E)-6-methyl-1-phenylhept-1-en-3-one?
You can request a quote for (E)-6-methyl-1-phenylhept-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-methyl-1-phenylhept-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-methyl-1-phenylhept-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.