tert-Butyl (2-aminoethyl)(phenyl)carbamate

HCID 53637964

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Basic information

CAS: 121492-11-3
Standard SMILES: CC(C)(C)OC(=O)N(CCN)c1ccccc1
InChIKey: AEACDUISWKMUHY-UHFFFAOYSA-N
Molecular formula: C13H20N2O2
Average molar mass: 236.31 g/mol
Monoisotopic mass: 236.15247789

Names & identifiers

Preferred name: tert-Butyl (2-aminoethyl)(phenyl)carbamate
IUPAC: tert-butyl N-(2-aminoethyl)-N-phenylcarbamate

Names & synonyms

tert-Butyl (2-aminoethyl)(phenyl)carbamate121492-11-3SCHEMBL9407535DTXSID601220924tert-Butyl (2-aminoethyl)phenylcarbamatetert-Butyl(2-aminoethyl)(phenyl)carbamate1,1-Dimethylethyl N-(2-aminoethyl)-N-phenylcarbamate

Database identifiers

CAS: 121492-11-3
PubChem CID: 53637964
DTXSID: DTXSID601220924

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 55.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 17
Formal charge: 0
Complexity: 242

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