KEGG   COMPOUND: C14715Help
Entry
C14715                      Compound                               

Name
4-Chloro-3,5-dimethylphenol;
Chloroxylenol
Formula
C8H9ClO
Exact mass
156.0342
Mol weight
156.6095
Structure
Mol fileKCF fileDB search
Remark
Same as: D03473
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D08 ANTISEPTICS AND DISINFECTANTS
   D08A ANTISEPTICS AND DISINFECTANTS
    D08AE Phenol and derivatives
     D08AE05 Chloroxylenol
      D03473  Chloroxylenol (USP/INN)
Animal drugs in Japan [BR:br08331]
 95  Agents for external use
  951  Antimicrobials for dermatologic use
   9519  Other antimicrobials for dermatologic use
    C14715  Chloroxylenol
  956  Bath and disinfectants preparations
   9562  Disinfectants preparations
    C14715  Chloroxylenol
 99  Agents for not mainly purpose of therapeutic
  992  Amphoteric soap and preparations
   9925  Cresols and preparations
    C14715  Chloroxylenol
BRITE hierarchy
Other DBs
CAS: 88-04-0
PubChem: 17395714
ChEBI: 34393
ChEMBL: CHEMBL398440
NIKKAJI: J4.285D
LinkDB All DBs
KCF data Show

ATOM        10
            1   C8x C    18.5500  -12.6700
            2   C8y C    18.5500  -14.0700
            3   C8y C    19.7624  -14.7700
            4   C8y C    20.9749  -14.0700
            5   C8x C    20.9749  -12.6700
            6   C8y C    19.7624  -11.9700
            7   O1a O    19.7624  -10.5702
            8   C1a C    22.2060  -14.7810
            9   X   Cl   19.7624  -16.1698
            10  C1a C    17.3376  -14.7700
BOND        10
            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     4   8 1
            9     3   9 1
            10    2  10 1

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