chempirical

N,N-Dimethylethanolamine bitartrate

C8H17NO7CAS 5988-51-2239.22 g/mol

Open in Covalent MOL file
NOHOHOOHOHOOH
AlcoholCarboxylic acidTertiary amine

Properties

Molecular formula
C8H17NO7
Molar mass
239.22 g/mol
Exact mass
239.1005 Da
logP
-2.58Crippen estimate
Polar surface area
138.5 Ų
H-bond donors / acceptors
5 / 6
Rotatable bonds
5
Stereocentres
R, Rin SMILES atom order

Identifiers

CAS number
5988-51-2
SMILES
CN(C)CCO.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIKey
UIEGYKVRCKDVKQ-LREBCSMRSA-N
InChI
InChI=1S/C4H11NO.C4H6O6/c1-5(2)3-4-6;5-1(3(7)8)2(6)4(9)10/h6H,3-4H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1

Weigh it out

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

Names and synonyms

10 names
  • Ethanol, 2-(dimethylamino)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
  • Ethanol, 2-(dimethylamino)-, tartrate (1:1)
  • Ethanol, 2-(dimethylamino)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt)
  • Ethanol, 2-(dimethylamino)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)
  • Dimethylaminoethanol bitartrate
  • N,N-Dimethylethanolamine-tartaric acid salt
  • 2-Dimethylaminoethanol tartrate
  • 2-Dimethylaminoethanol bitartrate
  • Deanol bitartrate
  • Liparon

Work with N,N-Dimethylethanolamine bitartrate

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

2-(Dimethylamino)ethanol108-01-052 % similar Dl-tartaric acid133-37-952 % similar D-Tartaric acid147-71-752 % similar 2,3-Dihydroxybutanedioic acid526-83-052 % similar Tartaric acid87-69-452 % similar Mucic acid526-99-850 % similar Saccharic acid87-73-050 % similar Diammonium tartrate3164-29-247 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia