KEGG   COMPOUND: C14456Help
Entry
C14456                      Compound                               

Name
4-Chloronitrobenzene;
1-Chloro-4-nitrobenzene
Formula
C6H4ClNO2
Exact mass
156.9931
Mol weight
157.5545
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C14456  4-Chloronitrobenzene
BRITE hierarchy
Other DBs
CAS: 
100-00-5
PubChem: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        10
            1   C8x C    27.6436  -17.2835
            2   C8x C    27.6436  -15.8840
            3   C8y C    28.8332  -15.1843
            4   C8x C    30.0927  -15.8840
            5   C8x C    30.0927  -17.2835
            6   C8y C    28.8332  -17.9832
            7   N2b N    28.8332  -19.3827 #+
            8   X   Cl   28.8332  -13.7848
            9   O3a O    27.6436  -20.0824
            10  O3a O    30.0227  -20.0824 #-
BOND        10
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     3   8 1
            9     7   9 2
            10    7  10 1

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