N-Boc-(R)-1-amino-2-propanol

C8H17NO3CAS 119768-44-4175.23 g/mol

Open in Covalent MOL file
NHOOHO
AlcoholCarbamate

Properties

Molecular formula
C8H17NO3
Molar mass
175.23 g/mol
Exact mass
175.1208 Da
logP
0.89Crippen estimate
Polar surface area
58.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
119768-44-4
SMILES
C[C@H](CNC(=O)OC(C)(C)C)O
InChIKey
YNJCFDAODGKHAV-ZCFIWIBFSA-N
InChI
InChI=1S/C8H17NO3/c1-6(10)5-9-7(11)12-8(2,3)4/h6,10H,5H2,1-4H3,(H,9,11)/t6-/m1/s1

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Work with N-Boc-(R)-1-amino-2-propanol

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

(R)-3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid132696-45-861 % similar (S)-3-(Boc-amino)-2-methylpropionic acid190897-47-361 % similar tert-Butyl N-(azetidin-3-ylmethyl)carbamate91188-15-760 % similar 4-(Boc-aminomethyl)piperidine135632-53-057 % similar 3-Boc-aminomethylpyrrolidine149366-79-055 % similar (S)-3-N-Boc-aminomethyl pyrrolidine173340-26-655 % similar tert-Butyl (4-oxocyclohexyl) methylcarbamate809273-70-954 % similar tert-Butyl N-(2-hydroxyethyl)carbamate26690-80-253 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

tert-Butyl N-((2R)-1-hydroxypropan-2-yl)carbamate106391-86-0 2-Ethylhexyl nitrate27247-96-7 (2S,3R)-2-Amino-3-(tert-butoxy)butanoic acid4378-13-6 (2-Hydroxyethyl)methylcarbamic acid 1,1-dimethylethyl ester57561-39-4 3-(Boc-amino)-1-propanol58885-58-8 1,1-Dimethylethyl N-[(1S)-2-hydroxy-1-methylethyl]carbamate79069-13-9

Elsewhere

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