1,2-Propanediol, 3-(2-methylallyloxy)-
TL;DR: 1,2-Propanediol, 3-(2-methylallyloxy)- (CAS 64049-44-1) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylprop-2-enoxy)propane-1,2-diol
Also Known As: 3-(2-Methylallyloxy)-1,2-propanediol, 3- -1,2-propanediol, 1,2-Propanediol, 3-(2-methylallyloxy)-, 3-(2-methylprop-2-enoxy)propane-1,2-diol, 3-[(2-methylprop-2-en-1-yl)oxy]propane-1,2-diol
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 64049-44-1 |
|---|---|
| SMILES | CC(=C)COCC(CO)O |
| InChIKey | HALWGCIWQTXDID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 3-(2-methylallyloxy)- (CAS 64049-44-1), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: 3-(2-methylprop-2-enoxy)propane-1,2-diol.
Chemical Property Profile of 1,2-Propanediol, 3-(2-methylallyloxy)-
Property Insights of 1,2-Propanediol, 3-(2-methylallyloxy)-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(2-methylallyloxy)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1,2-Propanediol, 3-(2-methylallyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(2-methylallyloxy)- has 2 hydrogen bond donor(s) and 3 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 1,2-Propanediol, 3-(2-methylallyloxy)-?
The CAS number of 1,2-Propanediol, 3-(2-methylallyloxy)- is 64049-44-1.
What is the molecular formula of 1,2-Propanediol, 3-(2-methylallyloxy)-?
The molecular formula of 1,2-Propanediol, 3-(2-methylallyloxy)- is C7H14O3.
What is the molecular weight of 1,2-Propanediol, 3-(2-methylallyloxy)-?
The molecular weight of 1,2-Propanediol, 3-(2-methylallyloxy)- is 146.09 g/mol.
Where can I buy 1,2-Propanediol, 3-(2-methylallyloxy)-?
You can request a quote for 1,2-Propanediol, 3-(2-methylallyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediol, 3-(2-methylallyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(2-methylallyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.