1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-
TL;DR: 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- (CAS 101864-09-9) is a chemical compound with molecular formula C19H24O4 and molecular weight 316.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis[(2-methylphenoxy)methyl]propane-1,3-diol
Also Known As: 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-, 2,2-Bis(o-tolyloxymethyl)-1,3-propanediol, 2,2-bis[(2-methylphenoxy)methyl]propane-1,3-diol, BRN 2538427, RefChem:219547
| Molecular Formula | C19H24O4 |
|---|---|
| Molecular Weight | 316.17 g/mol |
| LogP | 2.73224 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 316.16745 |
| Heavy Atoms | 23 |
| Complexity | 568.7716 |
Chemical Identifiers
| CAS Number | 101864-09-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(CO)(CO)COC2=CC=CC=C2C |
Product Overview
1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- (CAS 101864-09-9), with molecular formula C19H24O4 and molecular weight 316.17 g/mol. IUPAC: 2,2-bis[(2-methylphenoxy)methyl]propane-1,3-diol.
Chemical Property Profile of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-
Property Insights of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-
The XLogP value of 2.73224 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-. With a topological polar surface area (TPSA) of 58.92 Ų, 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- has 2 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, 2,2-bis(o-tolyloxymethyl)-?
The CAS number of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- is 101864-09-9.
What is the molecular formula of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-?
The molecular formula of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- is C19H24O4.
What is the molecular weight of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-?
The molecular weight of 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- is 316.17 g/mol.
Where can I buy 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)-?
You can request a quote for 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- 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, 2,2-bis(o-tolyloxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2,2-bis(o-tolyloxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.