tert-Butyl methylcarbamate

C₆H₁₃NO₂CAS 16066-84-5131.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₃NO₂
Molar mass: 131.17 g/mol
Exact mass: 131.0946 Da
logP: 1.14Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

16066-84-5

SMILES

CC(C)(C)OC(=O)NC

InChIKey

JHLVEBNWCCKSGY-UHFFFAOYSA-N

InChI

InChI=1S/C6H13NO2/c1-6(2,3)9-5(8)7-4/h1-4H3,(H,7,8)

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Names and synonyms

1 names

tert-Butyl-N-methylcarbamate

Work with tert-Butyl methylcarbamate

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-(tert-Butoxycarbonyl)-N'-methylethylenediamine122734-32-153 % similar 1,7-Bis-boc-1,4,7-triazaheptane117499-16-852 % similar N-Boc-1,3-diaminopropane hydrochloride127346-48-946 % similar tert-Butyl N-(1-(hydroxymethyl)cyclopropyl)carbamate107017-73-245 % similar (R)-tert-Butyl (2-oxooxetan-3-yl)carbamate126330-77-645 % similar N-Boc-(R)-1-amino-2-propanol119768-44-444 % similar tert-Butyl ((1R,2S)-2-fluorocyclopropyl)carbamate127199-16-044 % similar exo-3-Boc-aminotropane132234-68-544 % similar

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

Same formula

Dimethylaminoethyl acetate1421-89-2 L-Alloisoleucine1509-34-8 D-Alloisoleucine1509-35-9 L-tert-Leucine20859-02-3 N-Methyl-L-valine2480-23-1 D-tert-Leucine26782-71-8 D-Isoleucine319-78-8 D-Norleucine327-56-0

Elsewhere

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