Cas no 28787-36-2 (Maltol acetate)
Maltol acetate structure
Product Name:Maltol acetate
Maltol acetate Chemical and Physical Properties
Names and Identifiers
-
- Maltol acetate
- 2-Methyl-4-oxo-4H-pyran-3-yl acetate
- MALTOL-ACETATE
- 3-Acetoxy-2-methyl-4-pyrone
- 3-acetoxy-2-methyl-pyran-4-one
- 3-Acetyloxy-2-methyl-4H-pyran-4-one
- acetylmaltol
- EINECS 249-223-7
- DTXSID30951430
- -methyl-4-oxo-4H-pyran-3-yl acetate
- 3-Hydroxy-2-methyl-pyran-4-one acetate
- W-107029
- NS00047516
- InChI=1/C8H8O4/c1-5-8(12-6(2)9)7(10)3-4-11-5/h3-4H,1-2H
- 28787-36-2
- (2-methyl-4-oxopyran-3-yl) acetate
- SCHEMBL1845901
- FT-0628134
- AKOS006272817
- 3-Oxa-9-azatricyclo[3.3.1.02,4]nonan-7-ol, 9-methyl-, hydrochloride (1:1), (1.alpha.,2.beta.,4.beta.,5.alpha.,7.beta.)-
- NRQULFRLDJKNGP-UHFFFAOYSA-N
-
- Inchi： 1S/C8H8O4/c1-5-8(12-6(2)9)7(10)3-4-11-5/h3-4H,1-2H3
- InChI Key： NRQULFRLDJKNGP-UHFFFAOYSA-N
- SMILES： O1C=CC(C(=C1C)OC(C)=O)=O
Computed Properties
- Exact Mass: 168.04200
- Monoisotopic Mass: 168.04225873g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 285
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.5
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 56.51000
- LogP: 0.87350
Maltol acetate Related Literature
-
Liu Jiang,Minkui Zhang,Li Tang,Qinjie Weng,Yanhong Shen,Yongzhou Hu,Rong Sheng RSC Adv. 2016 6 17318
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