(Dimethylcarbamoyl)methyl 2-(4-hydroxyphenyl)acetate

C₁₂H₁₅NO₄CAS 59721-16-3237.25 g/mol

Open in Covalent MOL file

Alcohol Amide Ester

Properties

Molecular formula: C₁₂H₁₅NO₄
Molar mass: 237.25 g/mol
Exact mass: 237.1001 Da
logP: 0.57Crippen estimate
Polar surface area: 66.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 4

Identifiers

CAS number

59721-16-3

SMILES

CN(C)C(=O)COC(=O)Cc1ccc(O)cc1

InChIKey

QFOYXHSRNCTJOV-UHFFFAOYSA-N

InChI

InChI=1S/C12H15NO4/c1-13(2)11(15)8-17-12(16)7-9-3-5-10(14)6-4-9/h3-6,14H,7-8H2,1-2H3

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Names and synonyms

3 names

Benzeneacetic acid, 4-hydroxy-, 2-(dimethylamino)-2-oxoethyl ester
2-(Dimethylamino)-2-oxoethyl 2-(4-hydroxyphenyl)acetate
2-Dimethylamino-2-oxoethyl 4-hydroxybenzeneacetate

Work with (Dimethylcarbamoyl)methyl 2-(4-hydroxyphenyl)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

Same formula

(3S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid103733-66-0 Boc-3-aminobenzoic acid111331-82-9 N-(2,4-Dimethoxyphenyl)-3-oxobutanamide16715-79-0 γ-Benzyl L-glutamate1676-73-9 5-(Phenylmethyl) hydrogen D-glutamate2578-33-8 (2S)-2-[[(Phenylmethoxy)carbonyl]amino]butanoic acid42918-86-5 4-(Benzyloxycarbonylamino)butyric acid5105-78-2 Ethopabate59-06-3

Elsewhere

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