1,3-Dimethoxy-2-(2-nitroethen-1-yl)benzene

HCID 53899762CAS 120355-58-0
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Basic information

Standard SMILES
COc1cccc(OC)c1C=C[N+](=O)[O-]
InChIKey
HWHAPEJTWCSVGR-UHFFFAOYSA-N
Molecular formula
C10H11NO4
Average molar mass
209.2 g/mol
Monoisotopic mass
209.06880783

Names & identifiers

Preferred name
1,3-Dimethoxy-2-(2-nitroethen-1-yl)benzene
IUPAC
1,3-dimethoxy-2-(2-nitroethenyl)benzene

Names & synonyms

SCHEMBL4307858DTXSID40707506HWHAPEJTWCSVGR-UHFFFAOYSA-N1,3-Dimethoxy-2-(2-nitroethen-1-yl)benzene

Database identifiers

CAS
120355-58-0
PubChem CID
53899762
DTXSID
DTXSID40707506

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
64.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
15

Related reactions

3 records
New reaction record

Linked notes

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