Tert-butyl 2-(4-nitrophenylamino)propionate

HCID 58596136
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C
InChIKey
NLCCICWLWLAWAP-UHFFFAOYSA-N
Molecular formula
C13H18N2O4
Average molar mass
266.29 g/mol

Names & identifiers

Preferred name
Tert-butyl 2-(4-nitrophenylamino)propionate
IUPAC
tert-butyl 2-(4-nitroanilino)propanoate

Names & synonyms

SCHEMBL4828326NLCCICWLWLAWAP-UHFFFAOYSA-Ntert-butyl 2-(4-nitrophenylamino)propionatetert-butyl 2-[(4-nitrophenyl)amino]propanoateEN300-27731797

Database identifiers

PubChem CID
58596136

Properties

Computed structural properties

XLogP
3
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
19

Related reactions

2 records
New reaction record

Linked notes

Loading…