KEGG   COMPOUND: C10935
Entry
C10935                      Compound                               
Name
N,N-Diethyl-m-toluamide;
Diethyltoluamide;
DEET
Formula
C12H17NO
Exact mass
191.131
Mol weight
191.2695
Structure
Remark
Same as: D02379
Brite
Pesticides [BR:br08007]
 Pesticides
  Others
   Insect repellents
    C10935  N,N-Diethyl-m-toluamide
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P03 ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
   P03B INSECTICIDES AND REPELLENTS
    P03BX Other insecticides and repellents
     P03BX01 Diethyltoluamide
      D02379  Diethyltoluamide (USP/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for sanitation
  82 Pesticides
   D02379  Diethyltoluamide (USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   DEET; N,N-Diethyl-meta-toluamide
    D02379  Diethyltoluamide (USP/INN)
  Not used for human
   Insecticides
    D02379  Diethyltoluamide (USP/INN)
Animal drugs in Japan [BR:br08331]
 99  Agents for not mainly purpose of therapeutic
  993  Insecticides and insect-repellents
   9939  Other insecticides and insect repellents
    D02379  DEET
Other DBs
CAS: 134-62-3
PubChem: 13118
ChEBI: 7071
PDB-CCD: DE3[PDBj]
NIKKAJI: J5.598K
KCF data

ATOM        14
            1   N1c N    22.9607  -16.2923
            2   C1b C    22.9538  -17.6944
            3   C1a C    24.1653  -18.4051
            4   C1b C    24.1796  -15.6009
            5   C8x C    18.1205  -16.2923
            6   C8x C    18.1205  -17.6944
            7   C8y C    19.3315  -18.3990
            8   C8x C    20.5426  -17.6944
            9   C8y C    20.5426  -16.2923
            10  C8x C    19.3315  -15.5948
            11  C5a C    21.7490  -15.5948
            12  O5a O    21.7477  -14.1929
            13  C1a C    19.3334  -19.8010
            14  C1a C    25.3823  -16.3075
BOND        14
            1     5   6 2
            2     6   7 1
            3     7   8 2
            4     8   9 1
            5     9  10 2
            6    10   5 1
            7     2   3 1
            8     9  11 1
            9    11   1 1
            10    4   1 1
            11   11  12 2
            12    7  13 1
            13    1   2 1
            14    4  14 1

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