AG00GTC3

875756-97-1 | Hoechst 33342 3HCl

AG00GTC3

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CAS Number	875756-97-1
Catalog Number	AG00GTC3(AGN-PC-0VEYKD)
Chemical Name	Hoechst 33342 3HCl
IUPAC Name	2-(4-ethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole;trihydrochloride
InChI	InChI=1S/C27H28N6O.3ClH/c1-3-34-21-8-4-18(5-9-21)26-28-22-10-6-19(16-24(22)30-26)27-29-23-11-7-20(17-25(23)31-27)33-14-12-32(2)13-15-33;;;/h4-11,16-17H,3,12-15H2,1-2H3,(H,28,30)(H,29,31);3*1H
InChI Key	JABNPSKWVNCGMX-UHFFFAOYSA-N
MDL Number	MFCD00150074
Molecular Formula	C27H31Cl3N6O
Molecular Weight	561.9336
SMILES	[H]Cl.[H]Cl.[H]Cl.CN1CCN(C2=CC=C3C(N=C(C4=CC=C5C(N=C(C6=CC=C(OCC)C=C6)N5)=C4)N3)=C2)CC1
UNII	P976261J69
Synonyms	2,5'-bi-1h-benzimidazole, 2'-(4-ethoxyphenyl)-5-(4-methyl-1-piperazinyl)-, trihydrochloride, bisbenzimide ethoxide trihydrochloride, bisbenzimide h 33342, H33342, HOE 33342, HOE-33342, Hoechst 33342, Hoechst33342, 875756-97-1, Hoechst 33342 (trihydrochloride), Hoechst 33342 trihydrochloride, Bisbenzimide ethoxide trihydrochloride, UNII-P976261J69, bisBenzimide H 33342 trihydrochloride, Hoe 33342, Hoechst-33342, P976261J69, Bisbenzimide H 33342 Fluorochrome, Trihydrochloride, 2′-(4-Ethoxyphenyl)-5-(4-methyl-1-piperazinyl)-2,5′-bi-1H-benzimidazole, 3HCl, 2'-(4-Ethoxyphenyl)-5-(4-methyl-1-piperazinyl)-2,5'-bi-1H-benzimidazole trihydrochloride, Bisbenzimide H 33342, Bisbenzimide ethoxide trihydrochloride [MI], Hoechst # 33342, Hoechst #33342;, C27H28N6O.3ClH, bis-BENZIMIDE H-33342, CHEMBL3734796, Hoechst 33342 (hydrochloride), DTXSID40236482, 3722AH, HY-15559A, AKOS015903078, AKOS024458502, API0001730, CS-2953, GS-3430, 2,5'-Bi-1H-benzimidazole, 2'-(4-ethoxyphenyl)-5-(4-methyl-1-piperazinyl)-, trihydrochloride, TR-031835, 491H523, I14-18610, 2'-(4-ethoxyphenyl)-5-(4-methylpiperazin-1-yl)-1H,1'H-2,5'-bibenzo[d]imidazole trihydrochloride, 2-(4-ethoxyphenyl)-5-[5-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazol-2-yl]-1H-1,3-benzodiazole trihydrochloride, 2-(4-ethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole;trihydrochloride, 2-[2-(4-ethoxyphenyl)-1H-1,3-benzodiazol-5-yl]-5-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazole trihydrochloride, Hoechst 33342, HOE-33342, 23491-52-3,

Complexity	664
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	560.162g/mol
Formal Charge	0
Heavy Atom Count	37
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	561.936g/mol
Monoisotopic Mass	560.162g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	73.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313
UN Code

Certificate of Analysis

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