chempirical

Diacetyl-N-phenyldiethanolamine

C14H19NO4CAS 19249-34-4265.31 g/mol

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EsterTertiary amine

Properties

Molecular formula
C14H19NO4
Molar mass
265.31 g/mol
Exact mass
265.1314 Da
Boiling point
177–180 °C (at 4 Torr)
logP
1.62Crippen estimate
Polar surface area
55.8 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
7

Identifiers

CAS number
19249-34-4
SMILES
CC(=O)OCCN(CCOC(C)=O)c1ccccc1
InChIKey
XQGHEXBVXWBMGC-UHFFFAOYSA-N
InChI
InChI=1S/C14H19NO4/c1-12(16)18-10-8-15(9-11-19-13(2)17)14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3

Weigh it out

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

Names and synonyms

14 names · show all
  • Ethanol, 2,2′-(phenylimino)bis-, 1,1′-diacetate
  • Ethanol, 2,2′-(phenylimino)di-, diacetate (ester)
  • Ethanol, 2,2′-(phenylimino)bis-, diacetate (ester)
  • Ethanol, 2,2′-(phenylimino)di-, diacetate
  • N,N-Bis(2-acetoxyethyl)aniline
  • Bis(2-acetoxyethyl)aniline
  • N,N-Bis(acetoxyethyl)aniline
  • N,N-Bis(β-acetoxyethyl)aniline
  • N,N-Di(β-acetoxyethyl)aniline
  • N,N-Bis(2-acetyloxyethyl)aniline
  • N,N-Di(2-acetoxyethyl)aniline
  • O,O′-Diacetyl-N-phenyldiethanolamine
  • N,N-Bis(2-hydroxyethyl)aniline diacetate
  • (Phenylazanediyl)bis(ethane-2,1-diyl) diacetate

Work with Diacetyl-N-phenyldiethanolamine

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

3-[[2-(Acetyloxy)ethyl]phenylamino]propanenitrile22031-33-081 % similar N,N-Bis(2-hydroxyethyl)-3-methylaniline diacetate21615-36-173 % similar N-[3-[Bis[2-(acetyloxy)ethyl]amino]phenyl]acetamide27059-08-159 % similar Phenethyl acetate103-45-759 % similar 3-Phenylpropyl acetate122-72-557 % similar Ethylene glycol phenyl ether acetate6192-44-556 % similar 4-Phenylmorpholine92-53-553 % similar N-Phenylaza-15-crown-566750-10-552 % similar

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

Same formula

(S)-N-Boc-3-amino-3-phenylpropanoic acid103365-47-5 Boc-L-phenylalanine13734-34-4 β-[[(1,1-Dimethylethoxy)carbonyl]amino]benzenepropanoic acid14676-01-8 N-tert-Butoxycarbonyl-D-phenylalanine18942-49-9 N-(Benzyloxycarbonyl)-6-aminohexanoic acid1947-00-8 Benzyloxycarbonyl-L-leucine2018-66-8 Anisomycin22862-76-6 N-[(Phenylmethoxy)carbonyl]-L-isoleucine3160-59-6

Elsewhere

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