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Chemical synthesis
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Chloranil (TCBQ)Formula: C6Cl4O2 Molecular Weight: 245.88IUPAC Name: 2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dioneSMILES: C1(=C(C(=O)C(=C(C1=O)Cl)Cl)Cl)ClInChIKey: UGNWTBMOAKPKBL-UHFFFAOYSA-NInChI: InChI=1S/C6Cl4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11Synonyms: 2,3,5,6-Tetrachloro-p-benzoquinone | DivK1c_006946 | EN300-18125 | Spectrum5_001386 | Spergon | 2,5,6-Tetrachloroquin...
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Tetramethylthiuram disulfideFormula: C6H12N2S4 Molecular Weight: 240.43IUPAC Name: dimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioateSMILES: CN(C)C(=S)SSC(=S)N(C)CInChIKey: KUAZQDVKQLNFPE-UHFFFAOYSA-NInChI: InChI=1S/C6H12N2S4/c1-7(2)5(9)11-12-6(10)8(3)4/h1-4H3Synonyms: Nobecutan | Tetramethylthiurum disulfide | Arasan | Delsan | Arasan-SF-X | Spotrete | Tersan 75 | Tetramethylenethiur...
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Tetraethylthiuram disulfide, Aldehyde dehydrogenase inhibitorCas Number: 97-77-8 EC Number: 202-607-8Formula: C10H20N2S4 Molecular Weight: 296.54IUPAC Name: diethylcarbamothioylsulfanyl N,N-diethylcarbamodithioateSMILES: CCN(CC)C(=S)SSC(=S)N(CC)CCInChIKey: AUZONCFQVSMFAP-UHFFFAOYSA-NInChI: InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3Synonyms: TETD | Disulfiram | Contrapot | Ethyl tuads | Tetraethylthiuram disulfide | CHEBI:4659 | Ethyl Thiudad | Hoca | NSC 1...
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3-FluorotolueneCas Number: 352-70-5 EC Number: 206-524-8Formula: C7H7F Molecular Weight: 110.13IUPAC Name: 1-fluoro-3-methylbenzeneSMILES: CC1=CC(=CC=C1)FInChIKey: BTQZKHUEUDPRST-UHFFFAOYSA-NInChI: InChI=1S/C7H7F/c1-6-3-2-4-7(8)5-6/h2-5H,1H3Synonyms: 1-fluoranyl-3-methyl-benzene | SCHEMBL11881 | MFCD00000339 | 3-Fluorotoluene | AKOS000119943 | m-Fluorotoluene [UN238...
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1,2-NaphthoquinoneCas Number: 524-42-5 EC Number: 208-360-2Formula: C10H6O2 Molecular Weight: 158.15IUPAC Name: naphthalene-1,2-dioneSMILES: C1=CC=C2C(=C1)C=CC(=O)C2=OInChIKey: KETQAJRQOHHATG-UHFFFAOYSA-NInChI: InChI=1S/C10H6O2/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6HSynonyms: BBL027354 | 1,2-Naphthalenedione | HSDB 2036 | NAPHTHOQUINONE, 1,2- | 1,2-Dihydro-1,2-diketo-naphthalene | F30116 | 1...
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p-ToluidineFormula: C7H9N Molecular Weight: 107.15IUPAC Name: 4-methylanilineSMILES: CC1=CC=C(C=C1)NInChIKey: RZXMPPFPUUCRFN-UHFFFAOYSA-NInChI: InChI=1S/C7H9N/c1-6-2-4-7(8)5-3-6/h2-5H,8H2,1H3Synonyms: PT | p-Toluidin [Czech] | p-Toluidine 100 microg/mL in Methanol | p-Toluidine, for synthesis, 99% | AMINOBENZOIC ACID...
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2-FluorotolueneCas Number: 95-52-3 EC Number: 202-428-5Formula: C7H7F Molecular Weight: 110.13IUPAC Name: 1-fluoro-2-methylbenzeneSMILES: CC1=CC=CC=C1FInChIKey: MMZYCBHLNZVROM-UHFFFAOYSA-NInChI: InChI=1S/C7H7F/c1-6-4-2-3-5-7(6)8/h2-5H,1H3Synonyms: BRN 1853362 | FLUOROTOLUENE | O-FLUOROTOLUENE [MI] | o-Fluorotoluene [UN2388] [Flammable liquid] | F0001-2273 | 4-05...
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m-CresolCas Number: 108-39-4 EC Number: 203-577-9Formula: C7H8O Molecular Weight: 108.14IUPAC Name: 3-methylphenolSMILES: CC1=CC(=CC=C1)OInChIKey: RLSSMJSEOOYNOY-UHFFFAOYSA-NInChI: InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3Synonyms: 1-hydroxy-3-methylbenzene | METACRESOL [USP IMPURITY] | Metacresol, United States Pharmacopeia (USP) Reference Standa...
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m-NitrotolueneCas Number: 99-08-1 EC Number: 202-728-6Formula: C7H7NO2 Molecular Weight: 137.14IUPAC Name: 1-methyl-3-nitrobenzeneSMILES: CC1=CC(=CC=C1)[N+](=O)[O-]InChIKey: QZYHIOPPLUPUJF-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3Synonyms: 29A9W826KQ | SMR000677943 | UN 1664 | UNII-29A9W826KQ | m-Nitrotoluene, liquid or solid | N0274 | BDBM50008563 | meta...
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p-Nitrotoluene StandardCas Number: 99-99-0 EC Number: 202-808-0Formula: C7H7NO2 Molecular Weight: 137.14IUPAC Name: 1-methyl-4-nitrobenzeneSMILES: CC1=CC=C(C=C1)[N+](=O)[O-]InChIKey: ZPTVNYMJQHSSEA-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3Synonyms: 4-NITROPHENYLMETHANE | p-Methylnitrobenzene | 4-Methylnitrobenzene | CCRIS 2313 | NCGC00259015-01 | SCHEMBL7147554 | ...
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4-FluorotolueneCas Number: 352-32-9 EC Number: 206-520-6Formula: C7H7F Molecular Weight: 110.13IUPAC Name: 1-fluoro-4-methylbenzeneSMILES: CC1=CC=C(C=C1)FInChIKey: WRWPPGUCZBJXKX-UHFFFAOYSA-NInChI: InChI=1S/C7H7F/c1-6-2-4-7(8)5-3-6/h2-5H,1H3Synonyms: J-523918 | Z104473648 | 4-05-00-00800 (Beilstein Handbook Reference) | DTXSID7059852 | F0001-1019 | p-Fluoromethylben...
