Entry |
|
Name |
Cetrimonium chloride (BAN); Surfaktivo (TN) |
Formula |
C19H42N. Cl
|
Exact mass |
319.3006
|
Mol weight |
319.9965
|
Structure |
|
Simcomp |
|
Remark |
|
Efficacy |
Antiseptic, Disinfectant |
Comment |
Quaternary ammonium compound
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
D DERMATOLOGICALS
D08 ANTISEPTICS AND DISINFECTANTS
D08A ANTISEPTICS AND DISINFECTANTS
D08AJ Quaternary ammonium compounds
D08AJ02 Cetrimonium
D07672 Cetrimonium chloride (BAN)
R RESPIRATORY SYSTEM
R02 THROAT PREPARATIONS
R02A THROAT PREPARATIONS
R02AA Antiseptics
R02AA17 Cetrimonium
D07672 Cetrimonium chloride (BAN)
|
Other DBs |
|
KCF data |
ATOM 21
1 N1d N 15.0500 -17.9200 #+
2 C1b C 16.3100 -17.2200
3 C1b C 17.5000 -17.9200
4 C1b C 18.6900 -17.2200
5 C1b C 19.8800 -17.9200
6 C1b C 21.1400 -17.2200
7 C1b C 22.3300 -17.9200
8 C1b C 23.5200 -17.2200
9 C1b C 24.7800 -17.9200
10 C1b C 25.9700 -17.2200
11 C1b C 27.1600 -17.9200
12 C1b C 28.2800 -17.2200
13 C1b C 29.5400 -17.9200
14 C1b C 30.7300 -17.1500
15 C1b C 31.9900 -17.8500
16 C1b C 33.2500 -17.1500
17 C1a C 34.4400 -17.8500
18 C1a C 13.8600 -18.6200
19 C1a C 14.3500 -16.7300
20 C1a C 15.7500 -19.1100
21 X Cl 17.7100 -14.2800 #-
BOND 19
1 4 5 1
2 10 11 1
3 11 12 1
4 5 6 1
5 12 13 1
6 2 3 1
7 13 14 1
8 6 7 1
9 14 15 1
10 15 16 1
11 7 8 1
12 16 17 1
13 3 4 1
14 8 9 1
15 1 2 1
16 9 10 1
17 1 18 1
18 1 19 1
19 1 20 1
|