3-(Cyclohexen-1-yl)-1-nitrobenzene

HCID 22019642
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=[N+]([O-])c1cccc(C2=CCCCC2)c1
InChIKey
VEXHSRRREXSNAL-UHFFFAOYSA-N
Molecular formula
C12H13NO2
Average molar mass
203.24 g/mol

Names & identifiers

Preferred name
3-(Cyclohexen-1-yl)-1-nitrobenzene
IUPAC
1-(cyclohexen-1-yl)-3-nitrobenzene

Names & synonyms

SCHEMBL6099487SCHEMBL31518345VEXHSRRREXSNAL-UHFFFAOYSA-N3-(cyclohexen-1-yl)-1-nitrobenzene

Database identifiers

PubChem CID
22019642
Nikkaji
J2.952.589G

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15

Related reactions

2 records
New reaction record

Compound notes

Loading…