6-Phenylhex-3-en-2-one
TL;DR: 6-Phenylhex-3-en-2-one (CAS 56161-62-7) 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)-6-phenylhex-3-en-2-one
Also Known As: 6-Phenylhex-3-en-2-one, 6-phenyl-3-hexen-2-one, dodec-3t-en-2-one, (E)-6-phenylhex-3-en-2-one, 3-Hexen-2-one, 6-phenyl-
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 2.7644 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 285.2526 |
Chemical Identifiers
| CAS Number | 56161-62-7 |
|---|---|
| SMILES | CC(=O)/C=C/CCC1=CC=CC=C1 |
Product Overview
6-Phenylhex-3-en-2-one (CAS 56161-62-7), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: (E)-6-phenylhex-3-en-2-one.
Chemical Property Profile of 6-Phenylhex-3-en-2-one
Property Insights of 6-Phenylhex-3-en-2-one
The XLogP value of 2.7644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenylhex-3-en-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, 6-Phenylhex-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenylhex-3-en-2-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 6-Phenylhex-3-en-2-one?
The CAS number of 6-Phenylhex-3-en-2-one is 56161-62-7.
What is the molecular formula of 6-Phenylhex-3-en-2-one?
The molecular formula of 6-Phenylhex-3-en-2-one is C12H14O.
What is the molecular weight of 6-Phenylhex-3-en-2-one?
The molecular weight of 6-Phenylhex-3-en-2-one is 174.10 g/mol.
Where can I buy 6-Phenylhex-3-en-2-one?
You can request a quote for 6-Phenylhex-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenylhex-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenylhex-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.