chempirical

Hypotaurine

C2H7NO2SCAS 300-84-5109.14 g/mol

Open in Covalent MOL file
H2NSOOH
Primary amine

Properties

Molecular formula
C2H7NO2S
Molar mass
109.14 g/mol
Exact mass
109.0197 Da
Melting point
175–177 °C
logP
-0.83Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
300-84-5
SMILES
NCCS(=O)O
InChIKey
VVIUBCNYACGLLV-UHFFFAOYSA-N
InChI
InChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)

Weigh it out

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

Names and synonyms

5 names
  • Ethanesulfinic acid, 2-amino-
  • 2-Aminoethanesulfinic acid
  • Cystaminesulfinic acid
  • 2-Aminoethylsulfinic acid
  • 2-Aminoethane-1-sulfinic acid

Work with Hypotaurine

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

Ethanolamine141-43-533 % similar 3-Amino-1-propanol156-87-630 % similar

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

Same formula

N-Methylmethanesulfonamide1184-85-6 Ethanesulfonamide1520-70-3 Ammonium thioglycolate5421-46-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia