Methyl 5-(2-methoxyethoxy)-2-nitrobenzoate

HCID 66639151
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COCCOc1ccc([N+](=O)[O-])c(C(=O)OC)c1
InChIKey
BUDOLVSXDYVAJJ-UHFFFAOYSA-N
Molecular formula
C11H13NO6
Average molar mass
255.22 g/mol
Monoisotopic mass
255.07428713

Names & identifiers

Preferred name
Methyl 5-(2-methoxyethoxy)-2-nitrobenzoate
IUPAC
methyl 5-(2-methoxyethoxy)-2-nitrobenzoate

Names & synonyms

methyl 5-(2-methoxyethoxy)-2-nitrobenzoateSCHEMBL268658BUDOLVSXDYVAJJ-UHFFFAOYSA-NDB-188044773071-75-3

Database identifiers

PubChem CID
66639151

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
90.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
18

Related reactions

8 records
New reaction record

Compound notes

Loading…