N-Boc-(methylamino)acetaldehyde

C₈H₁₅NO₃CAS 123387-72-4173.21 g/mol

Open in Covalent MOL file

Aldehyde Carbamate

Properties

Molecular formula: C₈H₁₅NO₃
Molar mass: 173.21 g/mol
Exact mass: 173.1052 Da
logP: 1.05Crippen estimate
Polar surface area: 46.6 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

123387-72-4

SMILES

CC(C)(C)OC(=O)N(C)CC=O

InChIKey

MSWTVSDFEYSRMQ-UHFFFAOYSA-N

InChI

InChI=1S/C8H15NO3/c1-8(2,3)12-7(11)9(4)5-6-10/h6H,5H2,1-4H3

Weigh it out

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

Names and synonyms

1 names

tert-Butyl N-methyl-N-(2-oxoethyl)carbamate

Work with N-Boc-(methylamino)acetaldehyde

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

N-Boc-N-methylethylenediamine121492-06-657 % similar [(tert-Butoxycarbonyl)(methyl)amino]acetic acid13734-36-656 % similar N-(tert-Butoxycarbonyl)-2,5-dihydro-1H-pyrrole73286-70-155 % similar 3-(N-Boc-methylaminomethyl)azetidine1053655-53-053 % similar 1,1-Dimethylethyl N-(4-aminobutyl)-N-methylcarbamate144222-23-153 % similar 1,1-Dimethylethyl 1-pyrrolidinecarboxylate86953-79-947 % similar tert-Butyl 3-oxoazetidine-1-carboxylate398489-26-446 % similar 1,1-Dimethylethyl 1-piperidinecarboxylate75844-69-846 % similar

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

Same formula

N-Acetyl-L-leucine1188-21-2 N-Acetyl-L-isoleucine3077-46-1 Methyl 3-morpholinopropionate33611-43-7 Acexamic acid57-08-9 Ethyl 4-hydroxy-1-piperidinecarboxylate65214-82-6 Acetylleucine99-15-0

Elsewhere

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