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Chlorhexidine

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For Research Use Only | Not For Clinical Use
CATAPS55561
CAS55-56-1
Structure
MDL NumberMFCD00009673
SynonymsChlorohex, Tubulicid, Chlorohexidine, Nolvasan, Chlorhexamed forte, 2,4,11,13-Tetraazatetradecanediimidamide, N,N''-bis(4-chlorophenyl)-3,12-diimino- (9CI),N1,N14-Bis(4-chlorophenyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide, Biguanide, 1,1'-hexamethylenebis[5-(p-chlorophenyl)- (6CI,7CI,8CI), Promax, Dentosan, Eburos, Periogard, Hexident, Chlorhexidine, Soretol, Fimeil, Dezin, 1,6-Di(N-p-chlorophenylbiguanidino)hexane, Hexadol, 1,1'-Hexamethylenebis[5-(p-chlorophenyl)biguanide], 1,6-Bis[5-(p-chlorophenyl)biguanidino]hexane, Consepsis
IUPAC Name1-(4-chlorophenyl)-3-[N-[6-[[N-[N-(4-chlorophenyl)carbamimidoyl]carbamimidoyl]amino]hexyl]carbamimidoyl]guanidine
Molecular Weight505.45
Molecular FormulaC22H30Cl2N10
Canonical SMILESClc1ccc(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)Nc2ccc(Cl)cc2)cc1
InChIInChI=1S/C22H30Cl2N10/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34)
InChI KeyGHXZTYHSJHQHIJ-UHFFFAOYSA-N
REAXYS Number2826432
DescriptionUnited States Pharmacopeia (USP) Reference Standard
Accurate Mass504.2032
FormatNeat
Linear Formula[-(CH2)3NHC(=NH)NHC(=NH)NHC6H4Cl]2
MP134-136 °C (lit.)
Size200MG
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