KEGG   COMPOUND: C19231Help
Entry
C19231                      Compound                               

Name
3,3'-Dimethoxybenzidine;
ortho-Dianisidine
Formula
C14H16N2O2
Exact mass
244.1212
Mol weight
244.289
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C19231  3,3'-Dimethoxybenzidine
BRITE hierarchy
Other DBs
CAS: 119-90-4
PubChem: 124489903
ChEBI: 82321
ChEMBL: CHEMBL398363
PDB-CCD: DDJ[PDBj]
LinkDB All DBs
KCF data Show

ATOM        18
            1   C8y C    17.7153  -19.0927
            2   C8y C    17.0553  -20.3974
            3   C8x C    17.7946  -21.5863
            4   C8x C    19.1939  -21.5405
            5   C8y C    19.8538  -20.3058
            6   C8x C    19.1146  -19.1169
            7   C8y C    21.2538  -20.3058
            8   C8x C    21.9576  -21.5251
            9   C8x C    23.3576  -21.5252
            10  C8y C    24.0577  -20.3129
            11  C8y C    23.3540  -19.0936
            12  C8x C    21.9540  -19.0934
            13  N1a N    25.4799  -20.3132
            14  N1a N    15.6827  -20.3873
            15  O2a O    16.9986  -17.9042
            16  C1a C    15.6100  -17.9308
            17  O2a O    24.0534  -17.8826
            18  C1a C    25.4796  -17.8835
BOND        19
            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 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13    7  12 1
            14   10  13 1
            15    2  14 1
            16    1  15 1
            17   15  16 1
            18   11  17 1
            19   17  18 1

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