(3-tert-Butyl-isoxazol-5-yl)-carbamic acid 4-nitrophenyl ester

HCID 67408902
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)c1cc(NC(=O)Oc2ccc([N+](=O)[O-])cc2)on1
InChIKey
SOLZPDQWIIXQAL-UHFFFAOYSA-N
Molecular formula
C14H15N3O5
Average molar mass
305.29 g/mol

Names & identifiers

Preferred name
(3-tert-Butyl-isoxazol-5-yl)-carbamic acid 4-nitrophenyl ester
IUPAC
(4-nitrophenyl) N-(3-tert-butyl-1,2-oxazol-5-yl)carbamate

Names & synonyms

SCHEMBL2440741SOLZPDQWIIXQAL-UHFFFAOYSA-N(3-tert-Butyl-isoxazol-5-yl)-carbamic acid 4-nitrophenyl ester

Database identifiers

PubChem CID
67408902

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
110 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
22

Related reactions

15 records
New reaction record

Compound notes

Loading…