(±)-Tulobuterol

C₁₂H₁₈ClNOCAS 41570-61-0227.73 g/mol

Open in Covalent MOL file

Alcohol Halogen Secondary Amine

Properties

Molecular formula: C₁₂H₁₈ClNO
Molar mass: 227.73 g/mol
Exact mass: 227.1077 Da
Melting point: 89–91 °C
logP: 2.76Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Identifiers

CAS number

41570-61-0

SMILES

CC(C)(C)NCC(O)c1ccccc1Cl

InChIKey

YREYLAVBNPACJM-UHFFFAOYSA-N

InChI

InChI=1S/C12H18ClNO/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13/h4-7,11,14-15H,8H2,1-3H3

Weigh it out

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

Names and synonyms

7 names

Benzenemethanol, 2-chloro-α-[[(1,1-dimethylethyl)amino]methyl]-
2-Chloro-α-[[(1,1-dimethylethyl)amino]methyl]benzenemethanol
o-Chloro-α-[(tert-butylamino)methyl]benzyl alcohol
Tulobuterol
HN 078
2-(tert-Butylamino)-1-(2-chlorophenyl)ethan-1-ol
2-(tert-Butylamino)-1-(2-chlorophenyl)ethanol

Work with (±)-Tulobuterol

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

Same formula

1-Benzyl-3-piperidinol hydrochloride105973-51-1

Elsewhere

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