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2，4-DinitroanilineCas Number: 97-02-9Formula: C6H5N3O4 Molecular Weight: 183.13IUPAC Name: 2,4-dinitroanilineSMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NInChIKey: LXQOQPGNCGEELI-UHFFFAOYSA-NInChI: InChI=1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2Synonyms: 2,4-DINITROANILINE|97-02-9|Benzenamine, 2,4-dinitro-|1-Amino-2,4-dinitrobenzene|2,4-Dinitroanilin|2,4-Dinitrobenzenam... -
3,4-DichlorotolueneCas Number: 95-75-0 EC Number: 202-447-9Formula: C7H6Cl2 Molecular Weight: 161.03IUPAC Name: 1,2-dichloro-4-methylbenzeneSMILES: CC1=CC(=C(C=C1)Cl)ClInChIKey: WYUIWKFIFOJVKW-UHFFFAOYSA-NInChI: InChI=1S/C7H6Cl2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3Synonyms: 3,4-DICHLOROTOLUENE|95-75-0|1,2-Dichloro-4-methylbenzene|Benzene, 1,2-dichloro-4-methyl-|Toluene, 3,4-dichloro-|NSC 8...
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3-BromophenolCas Number: 591-20-8 EC Number: 209-706-5Formula: C6H5OBr Molecular Weight: 173.01IUPAC Name: 3-bromophenolSMILES: C1=CC(=CC(=C1)Br)OInChIKey: MNOJRWOWILAHAV-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrO/c7-5-2-1-3-6(8)4-5/h1-4,8HSynonyms: 3-BROMOPHENOL|591-20-8|m-Bromophenol|Phenol, 3-bromo-|3-Bromo-phenol|Phenol, m-bromo-|3-bromo phenol|MFCD00002253|CHE...
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Didecyl phthalateCas Number: 84-77-5 EC Number: 201-561-6Formula: C28H46O4 Molecular Weight: 446.66IUPAC Name: didecyl benzene-1,2-dicarboxylateSMILES: CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCInChIKey: PGIBJVOPLXHHGS-UHFFFAOYSA-NInChI: InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3Synonyms: DIDECYL PHTHALATE|84-77-5|Di-n-decyl phthalate|Decyl phthalate|Vinicizer 105|Vinysize 105|1,2-Benzenedicarboxylic aci...
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IsoeugenolCas Number: 97-54-1 EC Number: 202-590-7Formula: C10H12O2 Molecular Weight: 164.20IUPAC Name: 2-methoxy-4-[(E)-prop-1-enyl]phenolSMILES: CC=CC1=CC(=C(C=C1)O)OCInChIKey: BJIOGJUNALELMI-ONEGZZNKSA-NInChI: InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+Synonyms: BDBM50548724 | 2-methoxy-4-[(1E)-prop-1-en-1-yl]phenol | FEMA No. 2468 | Iso eugenol | Isoeugenol, predominantly tran...
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2,4-DiaminoanisoleCas Number: 615-05-4 EC Number: 210-406-1Formula: C7H10N2O Molecular Weight: 138.17IUPAC Name: 4-methoxybenzene-1,3-diamineSMILES: COC1=C(C=C(C=C1)N)NInChIKey: BAHPQISAXRFLCL-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2O/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,8-9H2,1H3Synonyms: 2,4-DIAMINOANISOLE|615-05-4|4-methoxybenzene-1,3-diamine|4-Methoxy-m-phenylenediamine|2,4-Diaminoanisol|1,3-Benzenedi...
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2-MethylnaphthaleneCas Number: 91-57-6 EC Number: 202-078-3Formula: C11H10 Molecular Weight: 142.2IUPAC Name: 2-methylnaphthaleneSMILES: CC1=CC2=CC=CC=C2C=C1InChIKey: QIMMUPPBPVKWKM-UHFFFAOYSA-NInChI: InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3Synonyms: InChI=1/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H | CAS-91-57-6 | NCGC00258393-01 | 2-Methylnaphthalene 10 microg...
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2-PentanoneCas Number: 107-87-9Formula: C5H10O Molecular Weight: 86.13IUPAC Name: pentan-2-oneSMILES: CCCC(=O)CInChIKey: XNLICIUVMPYHGG-UHFFFAOYSA-NInChI: InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3Synonyms: 2-Pentanone|PENTAN-2-ONE|107-87-9|METHYL PROPYL KETONE|Ethyl acetone|Pentanone|Ethylacetone|Methyl n-propyl ketone|Pr...
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Phenol disulfonic acidCas Number: 96-77-5 Compound CID: 66787Formula: C6H6O7S2 Molecular Weight: 254.24IUPAC Name: 4-hydroxybenzene-1,3-disulfonic acidSMILES: C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)OInChIKey: JXBUOZMYKQDZFY-UHFFFAOYSA-NInChI: InChI=1S/C6H6O7S2/c7-5-2-1-4(14(8,9)10)3-6(5)15(11,12)13/h1-3,7H,(H,8,9,10)(H,11,12,13)Synonyms: 1,3-Benzenedisulfonic
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1,1,2-TrichloroethaneFormula: C2H3Cl3 Molecular Weight: 133.4IUPAC Name: 1,1,2-trichloroethaneSMILES: C(C(Cl)Cl)ClInChIKey: UBOXGVDOUJQMTN-UHFFFAOYSA-NInChI: InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2Synonyms: 1,1,2-TRICHLOROETHANE|79-00-5|Ethane, 1,1,2-trichloro-|Vinyltrichloride|beta-Trichloroethane|1,1,2-Trichlorethane|1,2...
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2-HexanoneCas Number: 591-78-6Formula: C6H12O Molecular Weight: 100.16IUPAC Name: hexan-2-oneSMILES: CCCCC(=O)CInChIKey: QQZOPKMRPOGIEB-UHFFFAOYSA-NInChI: InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3Synonyms: 4-01-00-03298 (Beilstein Handbook Reference) | Methyl butyl ketone | methylbutyl ketone | SCHEMBL43282 | STR04219 | F...
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o-AnisidineCas Number: 90-04-0 EC Number: 201-963-1Formula: C7H9NO Molecular Weight: 123.16IUPAC Name: 2-methoxyanilineSMILES: COC1=CC=CC=C1NInChIKey: VMPITZXILSNTON-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3Synonyms: 2-Methoxyaniline | 2-METHOXY-ANILINE | 2-methoxyphenylamine | 2-Methoxy-phenylamine | o-Methoxyaniline | ORTHO-ANISID...
