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Search results for: '226-505-8'
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5-Bromovaleronitrile
Formula: C5H8BrNMolecular weight: 162.03Synonyms: FT-0620184 | DS-6416 | 1-bromo-4-cyanobutane | 1-bromo-4-cyano-butane | 3,4-Dihydro-4-methyl-1(2H)-n...SMILES: C(CCBr)CC#NInChIKey: NWWWGAKVHCSAEU-UHFFFAOYSA-NInChI: InChI=1S/C5H8BrN/c6-4-2-1-3-5-7/h1-4H2
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3,4-Bis(hydroxymethyl)furan
Cas Number: 14496-24-3Formula: C6H8O3Molecular weight: 128.13Synonyms: InChI=1/C6H8O3/c7-1-5-3-9-4-6(5)2-8/h3-4,7-8H,1-2H | EINECS 238-505-5 | [4-(hydroxymethyl)furan-3-yl...SMILES: C1=C(C(=CO1)CO)COInChIKey: RNKXUVJWMOMTHV-UHFFFAOYSA-NInChI: InChI=1S/C6H8O3/c7-1-5-3-9-4-6(5)2-8/h3-4,7-8H,1-2H2
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trans,trans-Muconic Acid
Cas Number: 3588-17-8Formula: C6H6O4Molecular weight: 142.11Synonyms: trans,trans-Muconic acid|MUCONIC ACID|3588-17-8|2,4-Hexadienedioic acid|trans-trans-muconic acid|(2E...SMILES: C(=CC(=O)O)C=CC(=O)OInChIKey: TXXHDPDFNKHHGW-ZPUQHVIOSA-NInChI: InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)/b3-1+,4-2+
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N-Ethylcyclohexylamine
Formula: C8H17NMolecular weight: 127.23Synonyms: N-Cyclohexyl-N-ethylamine | InChI=1/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H | E0506 | NCGC0034196...SMILES: CCNC1CCCCC1InChIKey: AGVKXDPPPSLISR-UHFFFAOYSA-NInChI: InChI=1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3
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Dinitrodurene
Cas Number: 5465-13-4Formula: C10H12N2O4Molecular weight: 224.22Synonyms: NSC 28984 | SCHEMBL7592620 | EINECS 226-766-8 | 1,4-Dinitro-2,3,5,6-tetramethylbenzene | PS-10453 | ...SMILES: CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])CInChIKey: AEPQXGFMAZTUEA-UHFFFAOYSA-NInChI: InChI=1S/C10H12N2O4/c1-5-6(2)10(12(15)16)8(4)7(3)9(5)11(13)14/h1-4H3
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2,6-Dimercaptopurine
Cas Number: 5437-25-2Formula: C5H4N4S2Molecular weight: 184.24Synonyms: D2517 | 3,7-Dihydro-1H-purine-2,6-dithione | NCGC00161966-01 | NSC685799 | NSC-685799 | Dithioxanthi...SMILES: C1=NC2=C(N1)C(=S)NC(=S)N2InChIKey: VQPMXSMUUILNFZ-UHFFFAOYSA-NInChI: InChI=1S/C5H4N4S2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
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Pactimibe sulfate
Cas Number: 608510-47-0Formula: C25H40N2O3.1/2H2O4SMolecular weight: 465.65Synonyms: EN300-37364279 | Pactimibe sulfate | 2-[7-(2,2-dimethylpropanoylamino)-4,6-dimethyl-1-octyl-2,3-dihy...SMILES: CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C.CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C.OS(=O)(=O)OInChIKey: MKJQESRCXYYHFR-UHFFFAOYSA-NInChI: InChI=1S/2C25H40N2O3.H2O4S/c2*1-7-8-9-10-11-12-14-27-15-13-19-17(2)20(16-21(28)29)18(3)22(23(19)27)26-24(30)25(4,5)6;1-5(2,3)4/h2*7-16H2,1-6H3,(H,26,30)(H,28,29);(H2,1,2,3,4)
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2-Guanidinobenzimidazole
Cas Number: 5418-95-1Formula: C8H9N5Molecular weight: 175.19Synonyms: 1-(1H-1,3-BENZIMIDAZOL-2-YL)GUANIDINE | 1-(1H-benzimidazol-2-yl)guanidine | FQ07TOI8GZ | AS-58345 | ...SMILES: C1=CC=C2C(=C1)NC(=N2)N=C(N)NInChIKey: JJWCTKUQWXYIIU-UHFFFAOYSA-NInChI: InChI=1S/C8H9N5/c9-7(10)13-8-11-5-3-1-2-4-6(5)12-8/h1-4H,(H5,9,10,11,12,13)
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Neutral red
Cas Number: 553-24-2Formula: C15H17CIN4Molecular weight: 288.78Synonyms: EINECS 209-035-8 | Phenazine, 3-amino-7-(dimethylamino)-2-methyl-, hydrochloride | NEUTRAL RED | C.I...SMILES: CC1=CC2=NC3=C(C=C(C=C3)N(C)C)N=C2C=C1N.ClInChIKey: PGSADBUBUOPOJS-UHFFFAOYSA-NInChI: InChI=1S/C15H16N4.ClH/c1-9-6-13-15(8-11(9)16)18-14-7-10(19(2)3)4-5-12(14)17-13;/h4-8H,16H2,1-3H3;1H
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Pactimibe sulfate
Cas Number: 608510-47-0(DMSO)Formula: C25H40N2O3.1/2H2O4SMolecular weight: 465.65SMILES: CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C.CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C.OS(=O)(=O)O
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3-Bromoquinoline
Formula: C9H6BrNMolecular weight: 208.05Synonyms: AKOS005203034 | FT-0615253 | AC-2815 | EINECS 226-237-1 | W-105751 | NSC3995 | NSC-3995 | CCG-339800...SMILES: C1=CC=C2C(=C1)C=C(C=N2)BrInChIKey: ZGIKWINFUGEQEO-UHFFFAOYSA-NInChI: InChI=1S/C9H6BrN/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-6H
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2,6-Pyridinedicarboxaldehyde
Formula: C7H5NO2Molecular weight: 135.12Synonyms: A7896 | DTXSID80202681 | NSC 13393 | P0949 | YSWG467 | 2,6-Pyridinedicarbaldehyde # | SB37598 | 2,6-...SMILES: C1=CC(=NC(=C1)C=O)C=OInChIKey: PMWXGSWIOOVHEQ-UHFFFAOYSA-NInChI: InChI=1S/C7H5NO2/c9-4-6-2-1-3-7(5-10)8-6/h1-5H
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Diethyl isoamylmalonate
Cas Number: 5398-08-3Formula: C12H22O4Molecular weight: 230.3Synonyms: diethyl 2-(3-methylbutyl)propanedioate | Malonic acid, isopentyl-, diethyl ester | 2-(3-methylbutyl)...SMILES: CCOC(=O)C(CCC(C)C)C(=O)OCCInChIKey: MPJCIHOJXMCSIM-UHFFFAOYSA-NInChI: InChI=1S/C12H22O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h9-10H,5-8H2,1-4H3
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Pactimibe, Acyl coenzyme A:cholesterol acyltransferase 2 inhibitor
Cas Number: 189198-30-9Formula: C25H40N2O3Molecular weight: 416.60Synonyms: CS-0018790 | MS-27258 | DTXSID80172315 | 2-[7-(2,2-Dimethylpropanoylamino)-4,6-dimethyl-1-octyl-2,3-...SMILES: CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)CInChIKey: TXIIZHHIOHVWJD-UHFFFAOYSA-NInChI: InChI=1S/C25H40N2O3/c1-7-8-9-10-11-12-14-27-15-13-19-17(2)20(16-21(28)29)18(3)22(23(19)27)26-24(30)25(4,5)6/h7-16H2,1-6H3,(H,26,30)(H,28,29)
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2-Methylindole-3-carboxaldehyde
Formula: C10H9NOMolecular weight: 159.18Synonyms: SCHEMBL248974 | AM20060663 | 2-Methyl-3-formylindole | NCGC00335106-01 | FT-0613060 | m-Methylacetan...SMILES: CC1=C(C2=CC=CC=C2N1)C=OInChIKey: CYZIVXOEJNAIBS-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO/c1-7-9(6-12)8-4-2-3-5-10(8)11-7/h2-6,11H,1H3
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2-methyl-1H-imidazole-4,5-dicarboxylic acid
Cas Number: 5313-35-9Formula: C6H6N2O4Molecular weight: 170.12Synonyms: 2-Methyl-1H-imidazole-4,5-dicarboxylic acid|5313-35-9|NSC72089|YM9VJ9ZHA6|2-methylimidazole-4,5-dica...SMILES: CC1=NC(=C(N1)C(=O)O)C(=O)OInChIKey: DCYCQZSHGUXYGP-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O4/c1-2-7-3(5(9)10)4(8-2)6(11)12/h1H3,(H,7,8)(H,9,10)(H,11,12)
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Trihexyl Borate
Cas Number: 5337-36-0Formula: C18H39BO3Molecular weight: 314.32Synonyms: AI3-60244 | EINECS 226-262-8 | Tri-n-hexyl borate | Trihexyl orthoborate | Hexyl borate, (C6H13O)3 B...SMILES: B(OCCCCCC)(OCCCCCC)OCCCCCCInChIKey: KDQYHGMMZKMQAA-UHFFFAOYSA-NInChI: InChI=1S/C18H39BO3/c1-4-7-10-13-16-20-19(21-17-14-11-8-5-2)22-18-15-12-9-6-3/h4-18H2,1-3H3
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4-Chloro-1-methylpiperidine
Cas Number: 5570-77-4Formula: C6H12ClNMolecular weight: 133.62Synonyms: A830767 | MFCD00016985 | DTXSID9063950 | C2465 | BCP05291 | EN300-206602 | 4-Chloro-1-methylpiperidi...SMILES: CN1CCC(CC1)ClInChIKey: MYGXGCCFTPKWIH-UHFFFAOYSA-NInChI: InChI=1S/C6H12ClN/c1-8-4-2-6(7)3-5-8/h6H,2-5H2,1H3
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3-Methyl-2-nitroanisole
Cas Number: 5345-42-6Formula: C8H9NO3Molecular weight: 167.16Synonyms: 3-Methyl-2-nitroanisole | EINECS 226-295-8 | 1-Methoxy-3-methyl-2-nitrobenzene # | 4,7-Methanoinden-...SMILES: CC1=C(C(=CC=C1)OC)[N+](=O)[O-]InChIKey: MGBRGNWARSQECY-UHFFFAOYSA-NInChI: InChI=1S/C8H9NO3/c1-6-4-3-5-7(12-2)8(6)9(10)11/h3-5H,1-2H3
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