3-Buten-2-one, 4-(3-cyclohexen-1-yl)-
TL;DR: 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- (CAS 80120-77-0) is a chemical compound with molecular formula C10H14O and molecular weight 150.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-cyclohex-3-en-1-ylbut-3-en-2-one
Also Known As: 4- -3-buten-2-one, 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-, 4-(cyclohex-3-en-1-yl)but-3-en-2-one, 4-(3-Cyclohexen-1-yl)-3-buten-2-one, (E)-4-cyclohex-3-en-1-ylbut-3-en-2-one
| Molecular Formula | C10H14O |
|---|---|
| Molecular Weight | 150.10 g/mol |
| LogP | 2.4879 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.10446 |
| Heavy Atoms | 11 |
| Complexity | 189.04945 |
Chemical Identifiers
| CAS Number | 80120-77-0 |
|---|---|
| SMILES | CC(=O)/C=C/C1CCC=CC1 |
Product Overview
3-Buten-2-one, 4-(3-cyclohexen-1-yl)- (CAS 80120-77-0), with molecular formula C10H14O and molecular weight 150.10 g/mol. IUPAC: (E)-4-cyclohex-3-en-1-ylbut-3-en-2-one.
Chemical Property Profile of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-
Property Insights of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-
The XLogP value of 2.4879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-. With a topological polar surface area (TPSA) of 17.07 Ų, 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- 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-Buten-2-one, 4-(3-cyclohexen-1-yl)-?
The CAS number of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- is 80120-77-0.
What is the molecular formula of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-?
The molecular formula of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- is C10H14O.
What is the molecular weight of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-?
The molecular weight of 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- is 150.10 g/mol.
Where can I buy 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-?
You can request a quote for 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Buten-2-one, 4-(3-cyclohexen-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Buten-2-one, 4-(3-cyclohexen-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.