Chlorhexidine Digluconate (20% in Water) structure

Chlorhexidine Digluconate (20% in Water)

2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)

Also Known As: Chlorhexidine gluconate, CHLORHEXIDINE DIGLUCONATE, Unisept, Chlorhexidine Di Gluconate, Chlorhexidine Digluconate (20% in Water), Chlorhexidine for system suitability A CRS, 1320-EP2298744A2, 1320-EP2308510A1, Chlorhexidine digluconate - 20% aqueous solution, 1,6-Bis(N5-[p-chlorophenyl]-N1-biguanido)hexane, 1,1?-Hexamethylenebis(5-[p-chlorophenyl]biguanide), (1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid, 2-[6-[[amino-[[amino-(4-chloroanilino)methylene]amino]methylene]amino]hexyl]-1-[amino-(4-chloroanilino)methylene]guanidine;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid, 2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid, D-Gluconic acid, compd. with N1,N14-bis(4-chlorophenyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide (2:1); D-Gluconic acid, compd. with 1,1'-hexamethylenebis[5-(p-chlorophenyl)biguanide] (2:1) (6CI); D-Gluconic acid, compd. with N,N''-bis(4-chlorophenyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide (2:1) (9CI); Gluconic acid, compd. with 1,1'-hexamethylenebis[5-(p-chlorophenyl)biguanide] (2:1), D- (8CI); 2,4,11,13-Tetraazatetradecanediimidamide, N,N''-bis(4-chlorophenyl)-3,12-diimino-, di-D-gluconate (9CI); Biguanide, 1,1'-hexamethylenebis[5-(p-chlorophenyl)-, di-D-gluconate (8CI); 1,1'-Hexamethylenebis[5-(p-chlorophenyl)biguanide] digluconate; 1,6-Bis(4-chlorophenyldiguanino)hexane digluconate; 1,6-Bis(p-chlorophenyldiguanido)hexane digluconate; 1,6-Bis[N5-(p-chlorophenyl)biguanido]hexane digluconate; Abacil; Acclean; Akhdez 3000; Antiseptol; Arlacide G; Bacticlens;

CAS: 18472-51-0
Molecular Formula C34H54Cl2N10O14
Molecular Weight 896.3198 g/mol
LogP -3.65
Topological Polar Surface Area 454.48 Ų
Hydrogen Bond Donors 18
Hydrogen Bond Acceptors 14
Rotatable Bonds 19
Exact Mass 896.3198
Heavy Atoms 60
Complexity 1555

Chemical Identifiers

CAS Number 18472-51-0
SMILES C1=CC(=CC=C1NC(=NC(=NCCCCCCN=C(N)N=C(N)NC2=CC=C(C=C2)Cl)N)N)Cl.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O

Product Overview

Chlorhexidine Digluconate (20% in Water) (CAS 18472-51-0), with molecular formula C34H54Cl2N10O14 and molecular weight 896.3198 g/mol. IUPAC: 2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid).

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