1,2-Propanediol, 3-(p-ethylbenzyloxy)-
TL;DR: 1,2-Propanediol, 3-(p-ethylbenzyloxy)- (CAS 63834-85-5) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-ethylphenyl)methoxy]propane-1,2-diol
Also Known As: 3-(p-Ethylbenzyloxy)-1,2-propanediol, 1,2-Propanediol, 3-(p-ethylbenzyloxy)-, 3-[(4-ethylbenzyl)oxy]propane-1,2-diol, 3-[(4-ethylphenyl)methoxy]propane-1,2-diol, MC 2579
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 63834-85-5 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)COCC(CO)O |
| InChIKey | DILZDMWFWNCRNK-UHFFFAOYSA-N |
Product Overview
1,2-Propanediol, 3-(p-ethylbenzyloxy)- (CAS 63834-85-5), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 3-[(4-ethylphenyl)methoxy]propane-1,2-diol.
Chemical Property Profile of 1,2-Propanediol, 3-(p-ethylbenzyloxy)-
Property Insights of 1,2-Propanediol, 3-(p-ethylbenzyloxy)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(p-ethylbenzyloxy)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1,2-Propanediol, 3-(p-ethylbenzyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(p-ethylbenzyloxy)- 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-(p-ethylbenzyloxy)-?
The CAS number of 1,2-Propanediol, 3-(p-ethylbenzyloxy)- is 63834-85-5.
What is the molecular formula of 1,2-Propanediol, 3-(p-ethylbenzyloxy)-?
The molecular formula of 1,2-Propanediol, 3-(p-ethylbenzyloxy)- is C12H18O3.
What is the molecular weight of 1,2-Propanediol, 3-(p-ethylbenzyloxy)-?
The molecular weight of 1,2-Propanediol, 3-(p-ethylbenzyloxy)- is 210.13 g/mol.
Where can I buy 1,2-Propanediol, 3-(p-ethylbenzyloxy)-?
You can request a quote for 1,2-Propanediol, 3-(p-ethylbenzyloxy)- 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-(p-ethylbenzyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(p-ethylbenzyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.