tert-Butyl 2-amino-2-methylpropanoate hydrochloride

C₈H₁₈ClNO₂CAS 84758-81-6195.69 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₈H₁₈ClNO₂
Molar mass: 195.69 g/mol
Exact mass: 195.1026 Da
logP: 1.49Crippen estimate
Polar surface area: 52.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

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

Identifiers

CAS number

84758-81-6

SMILES

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

InChIKey

YZKDXIFGPWUKTI-UHFFFAOYSA-N

InChI

InChI=1S/C8H17NO2.ClH/c1-7(2,3)11-6(10)8(4,5)9;/h9H2,1-5H3;1H

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Names and synonyms

1 names

Alanine, 2-methyl-, 1,1-dimethylethyl ester, hydrochloride

Work with tert-Butyl 2-amino-2-methylpropanoate hydrochloride

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

α-Aminoisobutyric acid methyl ester hydrochloride15028-41-862 % similar Ethyl α-aminoisobutyrate hydrochloride17288-15-256 % similar tert-Butyl trimethylacetate16474-43-450 % similar Glycine tert-butyl ester hydrochloride27532-96-345 % similar 1,1-Dimethylethyl 2-bromo-2-methylpropanoate23877-12-545 % similar tert-Butyl alaninate hydrochloride13404-22-343 % similar H-Beta-ala-otbu hcl58620-93-243 % similar D-Alanine tert-butyl ester hydrochloride59531-86-143 % similar

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

Same formula

N-Me-ala-otbu hcl103614-40-0 Carpronium chloride13254-33-6 Leucine ethyl ester hydrochloride2743-40-0 Ethyl 2-amino-3-methylvalerate hydrochloride56782-52-6 H-Gamma-abu-otbu hcl58640-01-0 Glycine hexyl ester75980-28-8

Elsewhere

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