chempirical

Ractopamine

C18H23NO3CAS 97825-25-7301.39 g/mol

Open in Covalent MOL file
OHNHHOOH
AlcoholPhenolSecondary amine

Properties

Molecular formula
C18H23NO3
Molar mass
301.39 g/mol
Exact mass
301.1678 Da
logP
2.74Crippen estimate
Polar surface area
72.7 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
7

Identifiers

CAS number
97825-25-7
SMILES
CC(CCc1ccc(O)cc1)NCC(O)c1ccc(O)cc1
InChIKey
YJQZYXCXBBCEAQ-UHFFFAOYSA-N
InChI
InChI=1S/C18H23NO3/c1-13(2-3-14-4-8-16(20)9-5-14)19-12-18(22)15-6-10-17(21)11-7-15/h4-11,13,18-22H,2-3,12H2,1H3

Weigh it out

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

Names and synonyms

2 names
  • Benzenemethanol, 4-hydroxy-α-[[[3-(4-hydroxyphenyl)-1-methylpropyl]amino]methyl]-
  • 4-Hydroxy-α-[[[3-(4-hydroxyphenyl)-1-methylpropyl]amino]methyl]benzenemethanol

Work with Ractopamine

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

Ractopamine hydrochloride90274-24-192 % similar Fenoterol13392-18-263 % similar Fenoterol hydrobromide1944-12-360 % similar Synephrine582-84-354 % similar Synephrine94-07-554 % similar Labetalol36894-69-651 % similar Synephrine hydrochloride5985-28-450 % similar Dobutamine hydrochloride49745-95-149 % similar

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

Same formula

Methyl 1,8-diethyl-1,3,4,9-tetrahydropyrano[3,4-B]indole-1-acetate122188-02-7

Elsewhere

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