Structure Database (LMSD)
Common Name
(E)-4-Nitrostilbene
Systematic Name
Synonyms
- trans-p-nitrostilbene
3D model of (E)-4-Nitrostilbene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
ZISCOWXWCHUSMH-VOTSOKGWSA-N
InChi (Click to copy)
InChI=1S/C14H11NO2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-11H/b7-6+
SMILES (Click to copy)
C1([N+]([O-])=O)=CC=C(/C=C/C2=CC=CC=C2)C=C1
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
17
Rings
2
Aromatic Rings
2
Rotatable Bonds
3
Van der Waals Molecular Volume
211.70
Topological Polar Surface Area
43.14
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
logP
3.77
Molar Refractivity
68.47
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Created at
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Updated at
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