(R)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxy-2-methylpropanoate

C₁₀H₁₉NO₅CAS 188476-28-0233.26 g/mol

Open in Covalent MOL file

Alcohol Carbamate Ester

Properties

Molecular formula: C₁₀H₁₉NO₅
Molar mass: 233.26 g/mol
Exact mass: 233.1263 Da
logP: 0.44Crippen estimate
Polar surface area: 84.9 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 3
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

188476-28-0

SMILES

C[C@@](CO)(C(=O)OC)NC(=O)OC(C)(C)C

InChIKey

OUUNEDPIBZNRMT-SNVBAGLBSA-N

InChI

InChI=1S/C10H19NO5/c1-9(2,3)16-8(14)11-10(4,6-12)7(13)15-5/h12H,6H2,1-5H3,(H,11,14)/t10-/m1/s1

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Names and synonyms

1 names

N-Boc-alpha-methyl-D-serine methyl ester

Work with (R)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxy-2-methylpropanoate

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

Methyl 3-hydroxy-2,2-dimethylpropanoate14002-80-346 % similar Methyl (S)-2-amino-3-hydroxy-2-methylpropanoate hydrochloride114396-63-343 % similar N-Boc-1-aminocyclobutanecarboxylic acid120728-10-141 % similar Methyl cis-3-(boc-amino)C...142733-63-940 % similar Methyl cis-4-(boc-amino)cyclohexanecarboxylate146307-51-939 % similar 1,3-Di-Boc-2-(2-hydroxyethyl)guanidine215050-11-638 % similar 1,7-Bis-boc-1,4,7-triazaheptane117499-16-838 % similar Methyl pivalate598-98-138 % similar

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

Same formula

N-Boc-(S)-2-amino-3-hydroxy-3-methylbutanoic acid102507-13-1 T-Boc-N-amido-peg1-acid1260092-44-1 N-[(1,1-Dimethylethoxy)carbonyl]-O-methyl-L-threonine48068-25-3 N,O-Bis(tert-butoxycarbonyl)hydroxylamine85006-25-3

Elsewhere

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