Dl-Noradrenaline bitartrate

C12H17NO9CAS 3414-63-9319.27 g/mol

Open in Covalent MOL file
H2NHOOHOHOHOOHOHOOH
AlcoholCarboxylic acidPhenolPrimary amine

Properties

Molecular formula
C12H17NO9
Molar mass
319.27 g/mol
Exact mass
319.0903 Da
Melting point
163–165 °C
logP
-2.03Crippen estimate
Polar surface area
201.8 Ų
H-bond donors / acceptors
8 / 8
Rotatable bonds
5
Stereocentres
R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Search the SDS library

Identifiers

CAS number
3414-63-9
SMILES
NCC(O)c1ccc(O)c(O)c1.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIKey
WNPNNLQNNJQYFA-LREBCSMRSA-N
InChI
InChI=1S/C8H11NO3.C4H6O6/c9-4-8(12)5-1-2-6(10)7(11)3-5;5-1(3(7)8)2(6)4(9)10/h1-3,8,10-12H,4,9H2;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

8 names
  • 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
  • Benzyl alcohol, α-(aminomethyl)-3,4-dihydroxy-, (±)-, tartrate (1:1) (salt)
  • 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt)
  • 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)
  • Dl-Norepinephrine bitartrate
  • (±)-Norepinephrine bitartrate
  • (±)-Noradrenaline bitartrate
  • DL-Noradrenaline L-bitartrate

Work with Dl-Noradrenaline 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tartaric acid87-69-4Free acid D-Tartaric acid147-71-7Free acid, enantiomer DL-Tartaric acid133-37-9Free acid, enantiomer 2,3-Dihydroxybutanedioic acid526-83-0Free acid, stereo not defined Noradrenaline51-41-2Free base, defined stereoisomer (±)-Norepinephrine138-65-8Free base (-)-Norepinephrine (+)-bitartrate51-40-1Defined stereoisomer Potassium bitartrate868-14-4Salt Sodium tartrate868-18-8Salt Potassium sodium tartrate304-59-6Salt Potassium tartrate921-53-9Salt N,N-Dimethylethanolamine bitartrate5988-51-2Salt

Similar compounds

(±)-3,4-Dihydroxymandelic acid14883-87-555 % similar Droxidopa23651-95-852 % similar (±)-Adrenaline329-65-747 % similar (-)-3,4-Dihydroxy-α-[2-(methylamino)ethyl]benzyl alcohol51-43-447 % similar Octopamine104-14-346 % similar Danshensu76822-21-445 % similar (±)-Epinephrine hydrochloride329-63-544 % similar (-)-Epinephrine hydrochloride55-31-244 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook