chempirical

Tranylcypromine sulfate

C9H13NO4SCAS 13492-01-8231.27 g/mol

Open in Covalent MOL file
H2NOSOHOOH
Primary amine

Properties

Molecular formula
C9H13NO4S
Molar mass
231.27 g/mol
Exact mass
231.0565 Da
logP
0.85Crippen estimate
Polar surface area
100.6 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
1
Stereocentres
R, Sin SMILES atom order

Identifiers

CAS number
13492-01-8
SMILES
N[C@@H]1C[C@H]1c1ccccc1.O=S(=O)(O)O
InChIKey
BTHVHSMCHJCPFU-LZPPVNAUNA-N
InChI
InChI=1/C9H11N.H2O4S/c10-9-6-8(9)7-4-2-1-3-5-7;1-5(2,3)4/h1-5,8-9H,6,10H2;(H2,1,2,3,4)/t8-,9+;/s2

Weigh it out

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

Names and synonyms

10 names
  • Cyclopropanamine, 2-phenyl-, (1R,2S)-rel-, sulfate (2:1)
  • Parnate
  • Dl-Tranylcypromine sulfate
  • Tylciprine
  • trans-2-Phenylcyclopropanamine sulfate (2:1)
  • Cyclopropanamine, 2-phenyl-, trans-, sulfate (2:1)
  • Parnetil
  • trans-2-Phenylcyclopropylamine hemisulfate
  • Cyclopropylamine, 2-phenyl-, sulfate (2:1), trans-(±)-
  • Cyclopropanamine, 2-phenyl-, trans-(±)-, sulfate (2:1)

Work with Tranylcypromine sulfate

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

Tranylcypromine155-09-969 % similar D-Amphetamine sulfate51-63-848 % similar Aniline sulfate542-16-547 % similar Phenylhydrazine sulfate52033-74-644 % similar (-)-Ephedrine sulfate134-72-541 % similar Benzeneacetic acid, α-hydroxy-, (αR)-(1R,2S)-compd. with 2-(3,4-difluorophenyl)cyclopropanamine (1:1)376608-71-840 % similar N,N-Dimethylanilinium hydrogen sulfate58888-49-639 % similar 1,4-Benzenediamine, N1-phenyl-, sulfate (2:1)4698-29-739 % similar

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

Same formula

2-(2-Methoxyethoxy)benzenesulfonamide82031-33-2

Elsewhere

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