N-(3,5-dinitrophenyl)acetamide

HCID 181595CAS 38802-18-5
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Basic information

Standard SMILES
CC(=O)Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1
InChIKey
ZXERTWPNZJETAC-UHFFFAOYSA-N
Molecular formula
C8H7N3O5
Average molar mass
225.16 g/mol
Monoisotopic mass
225.03857032

Names & identifiers

Preferred name
N-(3,5-dinitrophenyl)acetamide
IUPAC
N-(3,5-dinitrophenyl)acetamide

Names & synonyms

N-(3,5-dinitrophenyl)acetamide38802-18-5Acetamide, N-(3,5-dinitrophenyl)-3',5'-dinitroacetanilideSCHEMBL7335938CHEMBL4453333DTXSID20192072ZXERTWPNZJETAC-UHFFFAOYSA-NAE-562/03673013

Database identifiers

CAS
38802-18-5
PubChem CID
181595
DTXSID
DTXSID20192072
ChEMBL
CHEMBL4453333

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
121 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
16

Related reactions

4 records
New reaction record

Linked notes

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