chempirical

2-Methyl-2-adamantyl acrylate

C14H20O2CAS 249562-06-9220.31 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C14H20O2
Molar mass
220.31 g/mol
Exact mass
220.1463 Da
logP
2.93Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
249562-06-9
SMILES
C=CC(=O)OC1(C)C2CC3CC(C2)CC1C3
InChIKey
YRPLSAWATHBYFB-UHFFFAOYSA-N
InChI
InChI=1S/C14H20O2/c1-3-13(15)16-14(2)11-5-9-4-10(7-11)8-12(14)6-9/h3,9-12H,1,4-8H2,2H3

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Names and synonyms

5 names
  • 2-Propenoic acid, 2-methyltricyclo[3.3.1.13,7]dec-2-yl ester
  • 2-Methyladamantan-2-yl acrylate
  • Adamantate MA
  • MADA
  • 2-Methyladamantan-2-yl prop-2-enoate

Work with 2-Methyl-2-adamantyl acrylate

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-Adamantylacrylate121601-93-256 % similar 2-Methyl-2-adamantyl methacrylate177080-67-053 % similar tert-Butyl acrylate1663-39-450 % similar 3-Hydroxy-1-adamantyl acrylate216581-76-945 % similar Neopentyl glycol diacrylate2223-82-742 % similar Isobornyl acrylate5888-33-540 % similar 2-Ethylbutyl acrylate3953-10-440 % similar Tris(1-methylethyl)silyl 2-propenoate157859-20-639 % similar

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

Same formula

Dimethylbenzylcarbinyl butyrate10094-34-5 1-Adamantyl methacrylate16887-36-8 2,5-Di-tert-butyl-1,4-benzoquinone2460-77-7 3-Cyclohexenylmethyl 3-cyclohexenecarboxylate2611-00-9 8-Phenyloctanoic acid26547-51-3 4-(Heptyloxy)benzaldehyde27893-41-0 3,5-Di-tert-butyl-1,2-benzoquinone3383-21-9 Dicyclopentanyl methacrylate34759-34-7

Elsewhere

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