Name: Name:1,2,3-Propanetriol,1,3-diacetate
Brand: Angene
SKU: AG0038CP
Rating: 90 (10 reviews)

1,2,3-Propanetriol,1,3-diacetate

CAS No.:

105-70-4

Catalog Number:

AG0038CP

Molecular Formula:

C7H12O5

Molecular Weight:

176.1672

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Product Description

Catalog Number:

AG0038CP

Chemical Name:

1,2,3-Propanetriol,1,3-diacetate

CAS Number:

105-70-4

Molecular Formula:

C7H12O5

Molecular Weight:

176.1672

MDL Number:

MFCD00008717

IUPAC Name:

(3-acetyloxy-2-hydroxypropyl) acetate

InChI:

InChI=1S/C7H12O5/c1-5(8)11-3-7(10)4-12-6(2)9/h7,10H,3-4H2,1-2H3

InChI Key:

MPPODKLDCLFLKT-UHFFFAOYSA-N

SMILES:

OC(COC(=O)C)COC(=O)C

EC Number:

203-323-7

UNII:

G45CU3Z186

Properties

Complexity:

147

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.168g/mol

Monoisotopic Mass:

176.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6

Literature

Title	Journal
Hydrolysis of triacetin catalyzed by immobilized lipases: effect of the immobilization protocol and experimental conditions on diacetin yield.	Enzyme and microbial technology 20110506
Determination of the composition of acetylglycerol mixtures by (1)H NMR followed by GC investigation.	Analytical chemistry 20081115

Properties