3-Benzyl-4-heptanone
TL;DR: 3-Benzyl-4-heptanone (CAS 7492-37-7) is a chemical compound with molecular formula C14H20O and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylheptan-4-one
Also Known As: 3-Benzyl-4-heptanone, Morellone, 3-benzylheptan-4-one, Benzyl dipropyl ketone, 1-Benzyldipropyl ketone
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 3.6245 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 289.46683 |
Chemical Identifiers
| CAS Number | 7492-37-7 |
|---|---|
| SMILES | CCCC(=O)C(CC)CC1=CC=CC=C1 |
Product Overview
3-Benzyl-4-heptanone (CAS 7492-37-7), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 3-benzylheptan-4-one.
Chemical Property Profile of 3-Benzyl-4-heptanone
Property Insights of 3-Benzyl-4-heptanone
The XLogP value of 3.6245 indicates that 3-Benzyl-4-heptanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3-Benzyl-4-heptanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-4-heptanone 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 3-Benzyl-4-heptanone?
The CAS number of 3-Benzyl-4-heptanone is 7492-37-7.
What is the molecular formula of 3-Benzyl-4-heptanone?
The molecular formula of 3-Benzyl-4-heptanone is C14H20O.
What is the molecular weight of 3-Benzyl-4-heptanone?
The molecular weight of 3-Benzyl-4-heptanone is 204.15 g/mol.
Where can I buy 3-Benzyl-4-heptanone?
You can request a quote for 3-Benzyl-4-heptanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-4-heptanone?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-4-heptanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.