2-(2-Boc-aminoethoxy)ethanol

C₉H₁₉NO₄CAS 139115-91-6205.25 g/mol

Open in Covalent MOL file

Alcohol Carbamate Ether

Properties

Molecular formula: C₉H₁₉NO₄
Molar mass: 205.25 g/mol
Exact mass: 205.1314 Da
logP: 0.52Crippen estimate
Polar surface area: 67.8 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 5

Identifiers

CAS number

139115-91-6

SMILES

CC(C)(C)OC(=O)NCCOCCO

InChIKey

KSFVNEXYCULLEJ-UHFFFAOYSA-N

InChI

InChI=1S/C9H19NO4/c1-9(2,3)14-8(12)10-4-6-13-7-5-11/h11H,4-7H2,1-3H3,(H,10,12)

Weigh it out

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

Work with 2-(2-Boc-aminoethoxy)ethanol

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

tert-Butyl N-(2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)ethyl)carbamate106984-09-297 % similar tert-Butyl [2-(2-aminoethoxy)ethyl]carbamate127828-22-268 % similar T-Boc-N-amido-peg1-acid1260092-44-167 % similar 3,8,11-Trioxa-5-azatridecan-13-oic acid, 2,2-dimethyl-4-oxo-108466-89-365 % similar 1,7-Bis-boc-1,4,7-triazaheptane117499-16-857 % similar N-(tert-Butoxycarbonyl)-N'-methylethylenediamine122734-32-154 % similar Boc-11-aminoundecanoic acid10436-25-649 % similar N-Boc-1,3-diaminopropane hydrochloride127346-48-948 % similar

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

Same formula

N-Boc-diethanolamine103898-11-9 (S)-(-)-2-(Boc-amino)-1,4-butanediol128427-10-1 Panthenol16485-10-2 1,1-Dimethylethyl N-[(1R)-3-hydroxy-1-(hydroxymethyl)propyl]carbamate397246-14-9 (+)-Panthenol81-13-0

Elsewhere

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