6-Octen-3-one, 2,4,4,7-tetramethyl-
TL;DR: 6-Octen-3-one, 2,4,4,7-tetramethyl- (CAS 74338-72-0) is a chemical compound with molecular formula C12H22O and molecular weight 182.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4,7-tetramethyloct-6-en-3-one
Also Known As: claritone, 6-Octen-3-one, 2,4,4,7-tetramethyl-, 2,4,4,7-tetramethyl-6-octen-3-one, 2,4,4,7-tetramethyloct-6-en-3-one, 2,4,4,7-tetramethyl-oct-6-en-3-one
| Molecular Formula | C12H22O |
|---|---|
| Molecular Weight | 182.17 g/mol |
| LogP | 3.594 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.16707 |
| Heavy Atoms | 13 |
| Complexity | 205.16437 |
Chemical Identifiers
| CAS Number | 74338-72-0 |
|---|---|
| SMILES | CC(C)C(=O)C(C)(C)CC=C(C)C |
Product Overview
6-Octen-3-one, 2,4,4,7-tetramethyl- (CAS 74338-72-0), with molecular formula C12H22O and molecular weight 182.17 g/mol. IUPAC: 2,4,4,7-tetramethyloct-6-en-3-one.
Chemical Property Profile of 6-Octen-3-one, 2,4,4,7-tetramethyl-
Property Insights of 6-Octen-3-one, 2,4,4,7-tetramethyl-
The XLogP value of 3.594 indicates that 6-Octen-3-one, 2,4,4,7-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 6-Octen-3-one, 2,4,4,7-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Octen-3-one, 2,4,4,7-tetramethyl- 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-Octen-3-one, 2,4,4,7-tetramethyl-?
The CAS number of 6-Octen-3-one, 2,4,4,7-tetramethyl- is 74338-72-0.
What is the molecular formula of 6-Octen-3-one, 2,4,4,7-tetramethyl-?
The molecular formula of 6-Octen-3-one, 2,4,4,7-tetramethyl- is C12H22O.
What is the molecular weight of 6-Octen-3-one, 2,4,4,7-tetramethyl-?
The molecular weight of 6-Octen-3-one, 2,4,4,7-tetramethyl- is 182.17 g/mol.
Where can I buy 6-Octen-3-one, 2,4,4,7-tetramethyl-?
You can request a quote for 6-Octen-3-one, 2,4,4,7-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Octen-3-one, 2,4,4,7-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 6-Octen-3-one, 2,4,4,7-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.