7-Octen-3-one, 2,2-dimethyl-
TL;DR: 7-Octen-3-one, 2,2-dimethyl- (CAS 95664-94-1) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyloct-7-en-3-one
Also Known As: 2,2-dimethyloct-7-en-3-one, 7-Octen-3-one, 2,2-dimethyl-, 2,2-Dimethyl-7-octen-3-one, 2,2-Dimethyl-7-octene-3-one, J2.158.929B
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.9579 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 139.44199 |
Chemical Identifiers
| CAS Number | 95664-94-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)CCCC=C |
Product Overview
7-Octen-3-one, 2,2-dimethyl- (CAS 95664-94-1), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 2,2-dimethyloct-7-en-3-one.
Chemical Property Profile of 7-Octen-3-one, 2,2-dimethyl-
Property Insights of 7-Octen-3-one, 2,2-dimethyl-
The XLogP value of 2.9579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Octen-3-one, 2,2-dimethyl-. With a topological polar surface area (TPSA) of 17.07 Ų, 7-Octen-3-one, 2,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Octen-3-one, 2,2-dimethyl- 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 7-Octen-3-one, 2,2-dimethyl-?
The CAS number of 7-Octen-3-one, 2,2-dimethyl- is 95664-94-1.
What is the molecular formula of 7-Octen-3-one, 2,2-dimethyl-?
The molecular formula of 7-Octen-3-one, 2,2-dimethyl- is C10H18O.
What is the molecular weight of 7-Octen-3-one, 2,2-dimethyl-?
The molecular weight of 7-Octen-3-one, 2,2-dimethyl- is 154.14 g/mol.
Where can I buy 7-Octen-3-one, 2,2-dimethyl-?
You can request a quote for 7-Octen-3-one, 2,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Octen-3-one, 2,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 7-Octen-3-one, 2,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.