KEGG   COMPOUND: C14451
Entry
C14451                      Compound                               
Name
4-Chlorotoluene
Formula
C7H7Cl
Exact mass
126.0236
Mol weight
126.5835
Structure
Other DBs
CAS: 106-43-4
PubChem: 17395451
ChEBI: 34401
PDB-CCD: C4O[PDBj]
NIKKAJI: J3.610B
LinkDB
KCF data

ATOM        8
            1   C8x C    27.6504  -16.2406
            2   C8x C    27.6504  -17.6406
            3   C8y C    28.8629  -18.3406
            4   C8x C    30.0754  -17.6406
            5   C8x C    30.0754  -16.2406
            6   C8y C    28.8629  -15.5405
            7   C1a C    28.8629  -14.1407
            8   X   Cl   28.8629  -19.7405
BOND        8
            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

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