3-tert-Butoxy-2-(methoxymethyl)-1-propene
TL;DR: 3-tert-Butoxy-2-(methoxymethyl)-1-propene (CAS 23230-86-6) is a chemical compound with molecular formula C9H18O2 and molecular weight 158.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methoxymethyl)-3-[(2-methylpropan-2-yl)oxy]prop-1-ene
Also Known As: 3-tert-Butoxy-2- -1-propene, 3-tert-Butoxy-2-(methoxymethyl)-1-propene, Propene, 3-tert-butoxy-2-(methoxymethyl)-, 3-(tert-butoxy)-2-(methoxymethyl)prop-1-ene, 2-(tert-Butoxymethyl)-3-methoxyprop-1-ene
| Molecular Formula | C9H18O2 |
|---|---|
| Molecular Weight | 158.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.13068 |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 23230-86-6 |
|---|---|
| SMILES | CC(C)(C)OCC(=C)COC |
| InChIKey | NXXLWJTVEPCLDD-UHFFFAOYSA-N |
Product Overview
3-tert-Butoxy-2-(methoxymethyl)-1-propene (CAS 23230-86-6), with molecular formula C9H18O2 and molecular weight 158.13 g/mol. IUPAC: 2-(methoxymethyl)-3-[(2-methylpropan-2-yl)oxy]prop-1-ene.
Chemical Property Profile of 3-tert-Butoxy-2-(methoxymethyl)-1-propene
Property Insights of 3-tert-Butoxy-2-(methoxymethyl)-1-propene
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-tert-Butoxy-2-(methoxymethyl)-1-propene. With a topological polar surface area (TPSA) of 18.5 Ų, 3-tert-Butoxy-2-(methoxymethyl)-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-tert-Butoxy-2-(methoxymethyl)-1-propene has 0 hydrogen bond donor(s) and 2 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-tert-Butoxy-2-(methoxymethyl)-1-propene?
The CAS number of 3-tert-Butoxy-2-(methoxymethyl)-1-propene is 23230-86-6.
What is the molecular formula of 3-tert-Butoxy-2-(methoxymethyl)-1-propene?
The molecular formula of 3-tert-Butoxy-2-(methoxymethyl)-1-propene is C9H18O2.
What is the molecular weight of 3-tert-Butoxy-2-(methoxymethyl)-1-propene?
The molecular weight of 3-tert-Butoxy-2-(methoxymethyl)-1-propene is 158.13 g/mol.
Where can I buy 3-tert-Butoxy-2-(methoxymethyl)-1-propene?
You can request a quote for 3-tert-Butoxy-2-(methoxymethyl)-1-propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-tert-Butoxy-2-(methoxymethyl)-1-propene?
Yes, KEHONG BIO provides custom synthesis services for 3-tert-Butoxy-2-(methoxymethyl)-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.