Tert-butyl 3-methyl-2-methylamino-butanoate

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Basic information

CAS: 89537-01-9
Standard SMILES: CNC(C(=O)OC(C)(C)C)C(C)C
InChIKey: GQQBJNNCJGGHJG-UHFFFAOYSA-N
Molecular formula: C10H21NO2
Average molar mass: 187.28 g/mol
Monoisotopic mass: 187.15722891

Names & identifiers

Preferred name: Tert-butyl 3-methyl-2-methylamino-butanoate
IUPAC: tert-butyl 3-methyl-2-(methylamino)butanoate

Names & synonyms

89537-01-9tert-butyl 3-methyl-2-(methylamino)butanoateTERT-BUTYL 3-METHYL-2-METHYLAMINO-BUTANOATEtert-Butyl N-methylvalinateNCIOpen2_005336SCHEMBL7973604DTXSID70329078EN300-8143448

Database identifiers

CAS: 89537-01-9
PubChem CID: 417208
DTXSID: DTXSID70329078

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 38.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 13
Formal charge: 0
Complexity: 170

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Compound notes

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