Glycerine acetate

C₅H₁₀O₄CAS 26446-35-5134.13 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₁₀O₄
Molar mass: 134.13 g/mol
Exact mass: 134.0579 Da
Density: 1.206 g/mL (at 20 °C)
Melting point: −78 °C
Boiling point: 129–131 °C (at 3 Torr)
Flash point: 94 °C
Water solubility: ≥ 100 g/L (21.1 °C)
logP: -1.10Crippen estimate
Polar surface area: 66.8 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed95.1% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number

26446-35-5

SMILES

CC(=O)OCC(CO)O

InChIKey

KMZHZAAOEWVPSE-UHFFFAOYSA-N

InChI

InChI=1S/C5H10O4/c1-4(7)9-3-5(8)2-6/h5-6,8H,2-3H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

11 names

1,2,3-Propanetriol, monoacetate
Acetin, mono-
Acetin
Glyceryl acetate
Glyceryl monoacetate
Glycerol monoacetate
Glycerol acetate
Monoacetin
Glycerin monoacetate
Glycerine monoacetate
Eastman 9-45

Work with Glycerine acetate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Poly(glyceryl methacrylate)28474-30-859 % similar Glyceryl methacrylate5919-74-459 % similar Glyceryl monothioglycolate30618-84-953 % similar 2-Ethylbutyl acetate10031-87-552 % similar Isobutyl acetate110-19-050 % similar 1-Monostearin123-94-450 % similar 1-Monolaurin142-18-750 % similar 1-Monopalmitin19670-51-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(2-Methoxyethoxy)acetic acid16024-56-9 L-Deoxyribose18546-37-7 5-Deoxy-L-ribose18555-65-2 Dimethylolpropionic acid4767-03-7 Deoxyribose533-67-5 Methyl dimethoxyacetate89-91-8

Elsewhere

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