KEGG   COMPOUND: C11014
Entry
C11014                      Compound                               

Name
4-Fluoroaniline;
p-Fluoroaniline
Formula
C6H6FN
Exact mass
111.0484
Mol weight
111.1169
Structure
Comment
2-Fluoroaniline [CPD:C11010]
3-Fluoroaniline [CPD:C11013]
Other DBs
CAS: 371-40-4
PubChem: 13197
ChEBI: 28546
ChEMBL: CHEMBL32014
NIKKAJI: J33.843E
KCF data

ATOM        8
            1   C8x C    25.5368  -23.5044
            2   C8x C    25.5368  -24.9043
            3   C8y C    26.7530  -25.6078
            4   C8x C    27.9622  -24.9043
            5   C8x C    27.9622  -23.5044
            6   C8y C    26.7530  -22.8080
            7   N1a N    26.7547  -21.4082
            8   X   F    26.7547  -27.0075
BOND        8
            1     2   3 1
            2     3   4 2
            3     4   5 1
            4     5   6 2
            5     6   1 1
            6     6   7 1
            7     1   2 2
            8     3   8 1

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