Ethambutol hydrochloride

C₁₀H₂₆Cl₂N₂O₂CAS 1070-11-7277.23 g/mol

Open in Covalent MOL file

Alcohol Secondary amine

Properties

Molecular formula: C₁₀H₂₆Cl₂N₂O₂
Molar mass: 277.23 g/mol
Exact mass: 276.1371 Da
Melting point: 198.5–200.3 °C
logP: 0.55Crippen estimate
Polar surface area: 64.5 Å²
H-bond donors / acceptors: 4 / 4
Rotatable bonds: 9
Stereocentres: S, Sin SMILES atom order

Identifiers

CAS number

1070-11-7

SMILES

CC[C@@H](CO)NCCN[C@@H](CC)CO.Cl.Cl

InChIKey

AUAHHJJRFHRVPV-BZDVOYDHSA-N

InChI

InChI=1S/C10H24N2O2.2ClH/c1-3-9(7-13)11-5-6-12-10(4-2)8-14;;/h9-14H,3-8H2,1-2H3;2*1H/t9-,10-;;/m0../s1

Weigh it out

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

Names and synonyms

19 names · show all

1-Butanol, 2,2′-(1,2-ethanediyldiimino)bis-, hydrochloride (1:2), (2S,2′S)-
1-Butanol, 2,2′-(ethylenediimino)di-, dihydrochloride, (+)-
1-Butanol, 2,2′-(1,2-ethanediyldiimino)bis-, dihydrochloride, [S-(R*,R*)]-
1-Butanol, 2,2′-(1,2-ethanediyldiimino)bis-, dihydrochloride, (2S,2′S)-
CL 40881
Ethambutol dihydrochloride
d-2,2′-(Ethylenediimino)-di-1-butanol dihydrochloride
Myambutol
(+)-2,2′-(Ethylenediimino)di-1-butanol dihydrochloride
Dadibutol
Sural
Mycobutol
Dexambutol
Ebutol
Tibutol
Ethambutold dihydrochloride
Etapiam
Etibi
Tambutol

Work with Ethambutol hydrochloride

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

(+)-Ethambutol74-55-586 % similar 2-Ethylpiperazine13961-37-046 % similar L-Prolinol23356-96-943 % similar Prolinol498-63-543 % similar Prolinol68832-13-343 % similar 2-Ethylpiperidine1484-80-641 % similar 2-Piperidinemethanol3433-37-241 % similar 2-Ethyl-1-butanol97-95-038 % similar

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

Elsewhere

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