1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-
TL;DR: 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- (CAS 884-88-8) is a chemical compound with molecular formula C11H15ClO4 and molecular weight 246.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorophenoxy)methyl]-2-(hydroxymethyl)propane-1,3-diol
Also Known As: 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-, 2-[(2-chlorophenoxy)methyl]-2-(hydroxymethyl)propane-1,3-diol, 4-06-00-00790 (Beilstein Handbook Reference), 2-(o-Chlorophenoxymethyl)-2-hydroxymethyl-1,3-propanediol, 2-[(2-Chlorophenoxy)methyl]-2-(hydroxymethyl)-1,3-propanediol
| Molecular Formula | C11H15ClO4 |
|---|---|
| Molecular Weight | 246.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.06589 |
| Heavy Atoms | 16 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 884-88-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OCC(CO)(CO)CO)Cl |
| InChIKey | XZSZWIVHLAUZLZ-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- (CAS 884-88-8), with molecular formula C11H15ClO4 and molecular weight 246.07 g/mol. IUPAC: 2-[(2-chlorophenoxy)methyl]-2-(hydroxymethyl)propane-1,3-diol.
Chemical Property Profile of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-
Property Insights of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- has 3 hydrogen bond donor(s) and 4 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 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-?
The CAS number of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- is 884-88-8.
What is the molecular formula of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-?
The molecular formula of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- is C11H15ClO4.
What is the molecular weight of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-?
The molecular weight of 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- is 246.07 g/mol.
Where can I buy 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-?
You can request a quote for 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-(o-chlorophenoxymethyl)-2-hydroxymethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.