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[(2S)-2-acetyloxy-3-hydroxypropyl] acetate structure
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[(2S)-2-acetyloxy-3-hydroxypropyl] acetate

TL;DR: [(2S)-2-acetyloxy-3-hydroxypropyl] acetate (CAS 127179-48-0) is a chemical compound with molecular formula C7H12O5 and molecular weight 176.06847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(2S)-2-acetyloxy-3-hydroxypropyl] acetate

Also Known As: Diacetin, L-Glycerol 1,2-diacetate, 1,2-diacetyl-sn-glycerol, 1,2-Didecanoyl-sn-glycerol, 2,3-diacetoxy-propan-1-ol

CAS Number
127179-48-0
Molecular Formula
C7H12O5
Molecular Weight
176.06847 g/mol
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Technical Specifications

Molecular FormulaC7H12O5
Molecular Weight176.06847 g/mol
XLogP-0.3
Topological Polar Surface Area (TPSA)72.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass176.06847 Da
Heavy Atoms12
Complexity165.0
SMILESCC(=O)OC[C@H](CO)OC(=O)C
InChIKeyUXDDRFCJKNROTO-ZETCQYMHSA-N

Chemical Property Profile of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate

XLogP
-0.3
TPSA (Topological Polar Surface Area)
72.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
12
Complexity
165.0
Exact Mass
176.06847
Monoisotopic Mass
176.06847
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate

The XLogP value of -0.3 indicates that [(2S)-2-acetyloxy-3-hydroxypropyl] acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2S)-2-acetyloxy-3-hydroxypropyl] acetate. Following Lipinski's Rule of Five, [(2S)-2-acetyloxy-3-hydroxypropyl] acetate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate?

The CAS number of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate is 127179-48-0.

What is the molecular formula of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate?

The molecular formula of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate is C7H12O5.

What is the molecular weight of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate?

The molecular weight of [(2S)-2-acetyloxy-3-hydroxypropyl] acetate is 176.06847 g/mol.

Where can I buy [(2S)-2-acetyloxy-3-hydroxypropyl] acetate?

You can request a quote for [(2S)-2-acetyloxy-3-hydroxypropyl] acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [(2S)-2-acetyloxy-3-hydroxypropyl] acetate?

Yes, CoreyChem provides custom synthesis services for [(2S)-2-acetyloxy-3-hydroxypropyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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