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ECVAM 3T3NRU CITOTOXICITY: Reference chemicals used in the ECVAM validation study of the 3T3 NRU basal cytotoxicity assay to identify non-classified chemicals on the basis of the 2000 mg/kg b.w. threshold. The aim of this ECVAM Validation Study was to assess the capacity of the 3T3 Neutral Red Uptake (3T3 NRU) basal cytotoxicity assay to identify substances not requiring classification for acute oral systemic toxicity according to the EU Classification, Labelling and Packaging system (CLP) (i.e. oral LD50 > 2000 mg/kg). 56 chemicals were tested 1 (56 chemicals) download  excel file 
CASEINECSChemical NameSMILES
100-52-7 202-860-4BenzaldehydeO=Cc1ccccc1
100-97-0 202-905-8MethenamineC1N2CN3CN1CN(C2)C3
101-72-4 202-969-7N-isopropyl-N'-phenyl-p-phenylenediamineCC(C)NC1=CC=C(NC2=CC=CC=C2)C=C1
102-71-6 203-049-8TriethanolamineN(CCO)(CCO)CCO
102-76-1 203-051-9Glycerol triacetateCC(=O)OCC(COC(C)=O)OC(C)=O
103-11-7 203-080-72-ethylhexyl acrylateCCCCC(CC)COC(=O)C=C
1034-01-1 213-853-0Octyl 3,4,5-trihydroxybenzoateCCCCCCCCOC(=O)C1=CC(O)=C(O)C(O)=C1
10361-37-2 233-788-1Barium Chloride (BaCl2)[Ba](Cl)Cl
105-39-5 203-294-0Ethyl chloroacetateCCOC(=O)CCl
106-51-4 203-405-2p-BenzoquinoneO=C1C=CC(=O)C=C1
107-64-2 203-508-2Dimethyldioctadecylammonium chlorideC([N+](CCCCCCCCCCCCCCCCCC)(C)C)CCCCCCCCCCCCCCCCC.[ClH-]
108-46-3 203-585-2ResorcinolOc1cccc(O)c1
109-16-0 203-652-6Triethylene glycol dimethacrylateCC(=C)C(=O)OCCOCCOCCOC(=O)C(C)=C
109-77-3 203-703-2MalononitrileN#CCC#N
110-16-7 203-742-5Maleic acidO=C(O)C=CC(=O)O
110-97-4 203-820-9DiisopropanolamineCC(O)CNCC(C)O
112-07-2 203-933-32-Butoxyethyl acetateCCCCOCCOC(C)=O
112-34-5 203-961-62-(2-butoxyethoxy)ethanolCCCCOCCOCCO
120-51-4 204-402-9Benzyl benzoateO=C(OCc1ccccc1)c2ccccc2
120-82-1 204-428-01,2,4-trichlorobenzeneClc1ccc(Cl)c(Cl)c1
121-87-9 204-502-22-chloro-4-nitroanilinec1(cc(c(N)cc1)Cl)[N+](=O)[O-]
12125-02-9 235-186-4Ammonium Chloride ((NH4)Cl)[NH4+].[Cl-]
122-99-6 204-589-72-phenoxyethanolOCCOc1ccccc1
124-07-2 204-677-5Caprylic acidO=C(O)CCCCCCC
131-17-9 205-016-3Diallyl phthalateC=CCOC(=O)C1=C(C=CC=C1)C(=O)OCC=C
1314-13-2 215-222-5Zinc Oxide (Zno)[Zn]=O
1338-39-2 215-663-3Sorbitan monolaurateO1[C@@H]([C@H]([C@@H](O)C1)O)[C@H](COC(CCCCCCCCCCC)=O)O
134-32-7 205-138-71-naphthylamineNc1cccc2ccccc12
141-97-9 205-516-1Ethyl acetoacetateCCOC(=O)CC(=O)C
2386-87-0 219-207-4Diepoxide 126O=C(OCC1CCC2OC2C1)C1CCC2OC2C1
25646-77-9 247-162-0(4-ammonio-m-tolyl)ethyl(2-hydroxyethyl)ammonium sulphatec1(cc(c(cc1)N)C)N(CCO)CC.S(=O)(=O)(O)O
26523-78-4 247-759-6Tris(nonylphenyl) phosphiteCCCCCCCCCc1ccccc1OP(Oc2ccccc2CCCCCCCCC)Oc3ccccc3CCCCCCCCC
26761-40-0 247-977-1Di-'isodecyl' phthalatec1(c(cccc1)C(OCCCCCCCC(C)C)=O)C(OCCCCCCCC(C)C)=O
302-27-2 206-121-7AconitineCCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)[C@H](O)[C@](OC(=O)C)([C@@H]([C@H](OC)[C@H]23)C14)[C@H]5[C@H]6OC(=O)c7ccccc7
357-57-3 206-614-7Brucine[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=CC(OC)=C(OC)C=C7[C@@]1(CC[N@]2C4)[C@]6([H])[C@@]35[H]
3926-62-3 223-498-3Sodium salt of chloroacetic acid[O-]C(CCl)=O.[Na+]
557-05-1 209-151-9Zinc DistearateCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Zn+2]
57-13-6 200-315-5UreaO=C(N)N
579-66-8 209-445-72,6-DiethylanilineCCc1cccc(CC)c1N
60-00-4 200-449-4Edetic AcidO=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O
68515-48-0 271-090-91,2-Benzenedicarboxylic Acid, Di-C8-10-Branched Alkyl Esters, C9-RichCC(C)CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C
7758-98-7 231-847-6Copper SulphateS(=O)(=O)([O-])[O-].[Cu+2]
7778-80-5 231-915-5Potassium SulfateS(=O)(=O)([O-])[O-].[K+].[K+]
7779-90-0 231-944-3Trizinc Bis(Orthophosphate)P([O-])([O-])(=O)[O-].P(=O)([O-])([O-])[O-].[Zn+2].[Zn+2].[Zn+2]
79-94-7 201-236-92,2',6,6'-Tetrabromo-4,4'-IsopropylidenediphenolOc(c(cc(c1)C(c(cc(c(O)c2Br)Br)c2)(C)C)Br)c1Br
81-14-1 201-328-94'-Tert-Butyl-2',6'-Dimethyl-3',5'-DinitroacetophenoneCC(=O)C1=C(C)C(=C(C(=C1C)[N](=O)=O)C(C)(C)C)[N](=O)=O
85-44-9 201-607-5Phthalic AnhydrideO=C1OC(=O)c2ccccc12
866-84-2 212-755-5Tripotassium CitrateC(CC(=O)[O-])(CC(=O)[O-])(C(=O)[O-])O.[K+].[K+].[K+]
90-72-2 202-013-92,4,6-Tris(Dimethylaminomethyl)PhenolOc(c(cc(c1)CN(C)C)CN(C)C)c1CN(C)C
9005-64-5 500-018-3Tween 20
91-53-2 202-075-7EthoxyquinCCOc1ccc2NC(C)(C)C=C(C)c2c1
917-61-3 213-030-6Sodium CyanateC(#N)[O-].[Na+]
92-43-3 202-155-11-Phenyl-3-PyrazolidoneO=C1CCN(N1)C1=CC=CC=C1
95-50-1 202-425-91,2-Dichlorobenzenec1(c(cccc1)Cl)Cl
97-74-5 202-605-7Tetramethylthiuram MonosulphideCN(C)C(=S)SC(=S)N(C)C
98-86-2 202-708-7AcetophenoneCC(=O)c1ccccc1
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