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1-Nitro-2-(2-phenylethenyl)benzene

HCID 19908
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=[N+]([O-])c1ccccc1C=Cc1ccccc1
InChIKey
RYJATPLJVSILLB-UHFFFAOYSA-N
Molecular formula
C14H11NO2
Average molar mass
225.24 g/mol
Monoisotopic mass
225.07897859

Names & identifiers

Preferred name
1-Nitro-2-(2-phenylethenyl)benzene
IUPAC
1-nitro-2-(2-phenylethenyl)benzene

Names & synonyms

2-nitrostilbene1-nitro-2-(2-phenylethenyl)benzene4714-25-4nitrostilbeneSCHEMBL1578983SCHEMBL29594574RYJATPLJVSILLB-UHFFFAOYSA-N1-phenyl-2-(2-nitro-phenyl)-ethenel-phenyl-2-(2-nitro-phenyl)-ethene

Database identifiers

PubChem CID
19908

Properties

Computed structural propertiesFilling in

XLogP
3.8
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
276

Related reactions

9 records
New reaction record
HRID 188671 reaction equation
HRID 188671As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 429807 reaction equation
HRID 429807As reactantuspto-grants-2001_11
HRID 808527 reaction equation
HRID 808527As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 937704 reaction equation
HRID 937704As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1133370 reaction equation
HRID 1133370As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1282871 reaction equation
HRID 1282871As productuspto-grants-1976_08
HRID 1861826 reaction equation
HRID 1861826As reactantuspto-grants-2003_03
HRID 2084442 reaction equation
HRID 2084442As reactantuspto-grants-2004_04
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Compound notes

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