1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-
TL;DR: 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- (CAS 3894-18-6) is a chemical compound with molecular formula C15H18O3 and molecular weight 246.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(naphthalen-2-yloxymethyl)propane-1,3-diol
Also Known As: 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-, 2-Methyl-2-((2-naphthyloxy)methyl)-1,3-propanediol, 2-methyl-2-(naphthalen-2-yloxymethyl)propane-1,3-diol, 2-Methyl-2-[(2-naphthyloxy)methyl]-1,3-propanediol, 2-methyl-2-((naphthalen-2-yloxy)methyl)propane-1,3-diol
| Molecular Formula | C15H18O3 |
|---|---|
| Molecular Weight | 246.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.1256 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 3894-18-6 |
|---|---|
| SMILES | CC(CO)(CO)COC1=CC2=CC=CC=C2C=C1 |
| InChIKey | NSBBGDHVTCXAQV-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- (CAS 3894-18-6), with molecular formula C15H18O3 and molecular weight 246.13 g/mol. IUPAC: 2-methyl-2-(naphthalen-2-yloxymethyl)propane-1,3-diol.
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-
Property Insights of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- 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 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-?
The CAS number of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- is 3894-18-6.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-?
The molecular formula of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- is C15H18O3.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-?
The molecular weight of 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- is 246.13 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)-?
You can request a quote for 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- 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-methyl-2-((2-naphthyloxy)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-((2-naphthyloxy)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.