chempirical

Hydroxytetracaine

C15H24N2O3CAS 490-98-2280.37 g/mol

Open in Covalent MOL file
HNOONOH
EsterPhenolSecondary amineTertiary amine

Properties

Molecular formula
C15H24N2O3
Molar mass
280.37 g/mol
Exact mass
280.1787 Da
Melting point
156 °C
logP
2.32Crippen estimate
Polar surface area
61.8 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
8

Identifiers

CAS number
490-98-2
SMILES
CCCCNc1ccc(C(=O)OCCN(C)C)c(O)c1
InChIKey
DHCUQNSUUYMFGX-UHFFFAOYSA-N
InChI
InChI=1S/C15H24N2O3/c1-4-5-8-16-12-6-7-13(14(18)11-12)15(19)20-10-9-17(2)3/h6-7,11,16,18H,4-5,8-10H2,1-3H3

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Names and synonyms

10 names
  • Benzoic acid, 4-(butylamino)-2-hydroxy-, 2-(dimethylamino)ethyl ester
  • Salicylic acid, 4-(butylamino)-, 2-(dimethylamino)ethyl ester
  • 2-Dimethylaminoethyl 4-butylaminosalicylate
  • Salicaine (anesthetic)
  • Salicaine
  • Salicain
  • Oxypantocain
  • Rhenocain
  • Hydroxamethocaine
  • 2-(Dimethylamino)ethyl 4-(butylamino)-2-hydroxybenzoate

Work with Hydroxytetracaine

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

Amethocaine94-24-667 % similar Tetracaine hydrochloride136-47-064 % similar Benzonatate104-31-449 % similar Butyl salicylate2052-14-448 % similar Amyl salicylate2050-08-047 % similar Hexyl salicylate6259-76-346 % similar N-Octyl salicylate6969-49-946 % similar Ethyl 4-(butylamino)benzoate94-32-645 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook