![1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- structure](/static/products/5400/54004-45-4.webp)
1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-
TL;DR: 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- (CAS 54004-45-4) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(2-methylprop-2-enoxy)propan-1-ol
Also Known As: 2,2,5-Trimethyl-3-oxa-5-hexen-1-ol, 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-, 2-methyl-2-((2-methylallyl)oxy)propan-1-ol, 2-Methyl-2-(2-methyl-allyloxy)-propan-1-ol, 2-Methyl-2-[(2-methyl-2-propenyl)oxy]-1-propanol
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 54004-45-4 |
|---|---|
| SMILES | CC(=C)COC(C)(C)CO |
| InChIKey | VIYJKNBZRRVSLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- (CAS 54004-45-4), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: 2-methyl-2-(2-methylprop-2-enoxy)propan-1-ol.
Chemical Property Profile of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-
Property Insights of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- has 1 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 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-?
The CAS number of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- is 54004-45-4.
What is the molecular formula of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-?
The molecular formula of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- is C8H16O2.
What is the molecular weight of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-?
The molecular weight of 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- is 144.12 g/mol.
Where can I buy 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-?
You can request a quote for 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 2-methyl-2-[(2-methyl-2-propenyl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.