Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-
TL;DR: Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- (CAS 69856-00-4) is a chemical compound with molecular formula C12H16O and molecular weight 176.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-enoxypropan-2-ylbenzene
Also Known As: Cumyl allyl ether, 2-(Allyloxy)-2-phenylpropane, [1- -1-methylethyl]benzene, 2-prop-2-enoxypropan-2-ylbenzene, (1-(Allyloxy)-1-methylethyl)benzene
| Molecular Formula | C12H16O |
|---|---|
| Molecular Weight | 176.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 176.12012 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 69856-00-4 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)OCC=C |
| InChIKey | AZHRVNVMEODXMJ-UHFFFAOYSA-N |
Product Overview
Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- (CAS 69856-00-4), with molecular formula C12H16O and molecular weight 176.12 g/mol. IUPAC: 2-prop-2-enoxypropan-2-ylbenzene.
Chemical Property Profile of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-
Property Insights of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- 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 Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-?
The CAS number of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- is 69856-00-4.
What is the molecular formula of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-?
The molecular formula of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- is C12H16O.
What is the molecular weight of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-?
The molecular weight of Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- is 176.12 g/mol.
Where can I buy Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-?
You can request a quote for Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (1-methyl-1-(2-propen-1-yloxy)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.