3-乙基-2,2-二甲基环丁基甲基酮(E)
TL;DR: 3-乙基-2,2-二甲基环丁基甲基酮(E) (CAS 67465-27-4) 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.
3-乙基-2,2-二甲基环丁基甲基酮(E)
1-[(3S)-3-ethyl-2,2-dimethylcyclobutyl]ethanone
Also Known As: 3-Ethyl-2,2-dimethylcyclobutyl methyl (E)ketone, KETONE, 3-ETHYL-2,2-DIMETHYLCYCLOBUTYL METHYL (E)-, 1-[(3S)-3-ethyl-2,2-dimethylcyclobutyl]ethanone, Ethanone, 1-(3-ethyl-2,2-dimethylcyclobutyl)-, trans-, KETONE, 3-ETHYL-2,2-DIMETHYLCYCLOBUTYL METHYL (Z)-
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 67465-27-4 |
|---|---|
| SMILES | CC[C@H]1CC(C1(C)C)C(=O)C |
| InChIKey | XNOFWVNVNSRMKB-IENPIDJESA-N |
Product Overview
3-乙基-2,2-二甲基环丁基甲基酮(E) (CAS 67465-27-4), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 1-[(3S)-3-ethyl-2,2-dimethylcyclobutyl]ethanone.
Chemical Property Profile of 3-乙基-2,2-二甲基环丁基甲基酮(E)
Property Insights of 3-乙基-2,2-二甲基环丁基甲基酮(E)
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-乙基-2,2-二甲基环丁基甲基酮(E). With a topological polar surface area (TPSA) of 17.1 Ų, 3-乙基-2,2-二甲基环丁基甲基酮(E) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-乙基-2,2-二甲基环丁基甲基酮(E) 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-乙基-2,2-二甲基环丁基甲基酮(E)?
The CAS number of 3-乙基-2,2-二甲基环丁基甲基酮(E) is 67465-27-4.
What is the molecular formula of 3-乙基-2,2-二甲基环丁基甲基酮(E)?
The molecular formula of 3-乙基-2,2-二甲基环丁基甲基酮(E) is C10H18O.
What is the molecular weight of 3-乙基-2,2-二甲基环丁基甲基酮(E)?
The molecular weight of 3-乙基-2,2-二甲基环丁基甲基酮(E) is 154.14 g/mol.
Where can I buy 3-乙基-2,2-二甲基环丁基甲基酮(E)?
You can request a quote for 3-乙基-2,2-二甲基环丁基甲基酮(E) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-乙基-2,2-二甲基环丁基甲基酮(E)?
Yes, KEHONG BIO provides custom synthesis services for 3-乙基-2,2-二甲基环丁基甲基酮(E) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.