chempirical

2-Hydroxy-4′-(2-hydroxyethoxy)-2-methylpropiophenone

C12H16O4CAS 106797-53-9224.26 g/mol

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HOOOOH
AlcoholEtherKetone

Properties

Molecular formula
C12H16O4
Molar mass
224.26 g/mol
Exact mass
224.1049 Da
logP
1.01Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
5

Identifiers

CAS number
106797-53-9
SMILES
CC(C)(O)C(=O)c1ccc(OCCO)cc1
InChIKey
GJKGAPPUXSSCFI-UHFFFAOYSA-N
InChI
InChI=1S/C12H16O4/c1-12(2,15)11(14)9-3-5-10(6-4-9)16-8-7-13/h3-6,13,15H,7-8H2,1-2H3

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Names and synonyms

26 names · show all
  • 1-Propanone, 2-hydroxy-1-[4-(2-hydroxyethoxy)phenyl]-2-methyl-
  • UV 2959
  • IRG 2959
  • 2-Hydroxy-4′-hydroxyethoxy-2-methylpropiophenone
  • Photoinitiator 2959
  • 2-Hydroxy-2-methyl-1-[4-(2-hydroxyethoxy)phenyl]propan-1-one
  • Photoinitiator 659
  • Irgacure I 2959
  • 3-[4-(2-Hydroxyethoxy)phenyl]-2-methyl-3-oxopropan-2-ol
  • IC 2959
  • JRCure 1113
  • Omnirad 2959
  • Gencure 2959
  • Irgacure D 2959
  • 2-Hydroxy-1-[4-(2-hydroxyethoxy)phenyl]-2-methyl-1-propanone
  • Darocur 2959
  • ZLI 2959
  • Irgacure 2959
  • Darocur 2595
  • 4-(2-Hydroxyethoxy)phenyl 2-hydroxy-2-propyl ketone
  • 1-[4-(2-Hydroxyethoxy)phenyl]-2-hydroxy-2-methyl-1-propanone
  • D 2959
  • DC 2959
  • I 2959
  • 1-[4-(2-Hydroxyethoxy)phenyl]-2-hydroxy-2-methyl-1-propan-1-one
  • IRGC 2959

Work with 2-Hydroxy-4′-(2-hydroxyethoxy)-2-methylpropiophenone

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

1,1′-(Oxydi-4,1-phenylene)bis[2-hydroxy-2-methyl-1-propanone]71868-15-065 % similar 2-Hydroxy-2-methyl-1-phenylpropan-1-one7473-98-553 % similar Iht-pi 18568400-54-453 % similar Hydroquinone bis(2-hydroxyethyl) ether104-38-150 % similar Triton X-1009002-93-144 % similar 4-(2-Hydroxyethoxy)benzaldehyde22042-73-543 % similar 2-(4-Chlorophenoxy)ethanol1892-43-943 % similar 2-(4-Bromophenoxy)ethanol34743-88-943 % similar

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

Same formula

Benzo-12-crown-414174-08-4 Ethyl 3,4-dimethoxybenzeneacetate18066-68-7 Pogostone23800-56-8 2-Phenyl-1,3-dioxane-5,5-dimethanol2425-41-4 3,4-Diethoxybenzeneacetic acid38464-04-9 1,3-Adamantanedicarboxylic acid39269-10-8 Olivetolic acid491-72-5 Ethyl 3-(4-hydroxy-3-methoxyphenyl)propionate61292-90-8

Elsewhere

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