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Glycerol monoacetate

CAT: 0063-72202573Size: 100 gDry Ice: NoHazardous: No
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CAT#:0063-72202573Size:100 g
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CAS Number
26446-35-5

Chemical Information

Glyceryl Acetate

Acetin is a clear colorless to pale yellow viscous liquid with a characteristic odor. (NTP, 1992)

CAS Number26446-35-5
PubChem CID33510
IUPAC Name2,3-dihydroxypropyl acetate
Molecular FormulaC5H10O4
Molecular Weight134.13
XLogP-1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity91
SMILES
CC(=O)OCC(CO)O
InChI
InChI=1S/C5H10O4/c1-4(7)9-3-5(8)2-6/h5-6,8H,2-3H2,1H3
InChIKey
KMZHZAAOEWVPSE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Glyceryl Acetate
CAS: 26446-35-5
CID: 33510
Formula: C5H10O4
MW: 134.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight134.13
XLogP3-1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass134.05790880
Monoisotopic Mass134.05790880
Topological Polar Surface Area66.8 Ų
Heavy Atom Count9
Formal Charge0
Complexity91
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes