KEGG   COMPOUND: C06647
Entry
C06647                      Compound                               
Name
4-Chloroacetophenone;
p-Chloroacetophenone
Formula
C8H7ClO
Exact mass
154.0185
Mol weight
154.5936
Structure
Reaction
R05344 R05480
Other DBs
CAS: 99-91-2
PubChem: 8873
3DMET: B01016
NIKKAJI: J38.176D
LinkDB
KCF data

ATOM        10
            1   C8y C    25.7355  -17.2206
            2   C5a C    26.9468  -16.5161
            3   C8x C    25.7355  -18.6239
            4   C8x C    24.5302  -16.5161
            5   C1a C    28.1579  -17.2206
            6   O5a O    26.9468  -15.1186
            7   C8x C    24.5302  -19.3169
            8   C8x C    23.3132  -17.2206
            9   C8y C    23.3132  -18.6239
            10  X   Cl   22.0962  -19.3169
BOND        10
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 2
            7     4   8 1
            8     7   9 1
            9     9  10 1
            10    8   9 2

» Japanese version

DBGET integrated database retrieval system