1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-
TL;DR: 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- (CAS 13754-10-4) is a chemical compound with molecular formula C14H18O5 and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyloxy-3-phenylmethoxypropyl) acetate
Also Known As: 3-Benzyloxy-1,2-diacetyl-1,2-propanediol, 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-, (2-acetyloxy-3-phenylmethoxypropyl) acetate, 3-(benzyloxy)propane-1,2-diyldiacetate, 3-(Phenylmethoxy)-1,2-propanediol diacetate
| Molecular Formula | C14H18O5 |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 266.11542 |
| Heavy Atoms | 19 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 13754-10-4 |
|---|---|
| SMILES | CC(=O)OCC(COCC1=CC=CC=C1)OC(=O)C |
| InChIKey | PZJWZGWBDMSONK-UHFFFAOYSA-N |
Product Overview
1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- (CAS 13754-10-4), with molecular formula C14H18O5 and molecular weight 266.12 g/mol. IUPAC: (2-acetyloxy-3-phenylmethoxypropyl) acetate.
Chemical Property Profile of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-
Property Insights of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- has 0 hydrogen bond donor(s) and 5 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-benzyloxy-1,2-diacetyl-?
The CAS number of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- is 13754-10-4.
What is the molecular formula of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-?
The molecular formula of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- is C14H18O5.
What is the molecular weight of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-?
The molecular weight of 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- is 266.12 g/mol.
Where can I buy 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl-?
You can request a quote for 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- 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-benzyloxy-1,2-diacetyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-benzyloxy-1,2-diacetyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.