KEGG   COMPOUND: C19270Help
Entry
C19270                      Compound                               

Name
2-Nitroanisole;
o-Nitroanisole
Formula
C7H7NO3
Exact mass
153.0426
Mol weight
153.1354
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C19270  2-Nitroanisole
BRITE hierarchy
Other DBs
CAS: 91-23-6
PubChem: 124489942
ChEBI: 48722
ChEMBL: CHEMBL166415
LinkDB All DBs
KCF data Show

ATOM        11
            1   C8x C    15.6100  -19.1100
            2   C8x C    15.6100  -20.5100
            3   C8x C    16.8224  -21.2100
            4   C8y C    18.0349  -20.5100
            5   C8y C    18.0349  -19.1100
            6   C8x C    16.8224  -18.4100
            7   O2a O    19.2660  -18.3990
            8   C1a C    20.4712  -19.0947
            9   N2b N    19.2660  -21.2210 #+
            10  O3a O    20.7512  -20.6653 #-
            11  O3a O    19.2657  -22.6099
BOND        11
            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     5   7 1
            8     7   8 1
            9     4   9 1
            10    9  10 1
            11    9  11 2

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