Toluenes

2,4,6-Trinitrotoluene, SPEX CertiPrep™

CAS: 118-96-7 Molecular Formula: C7H5N3O6 Molecular Weight (g/mol): 227.132 InChI Key: SPSSULHKWOKEEL-UHFFFAOYSA-N PubChem CID: 8376 ChEBI: CHEBI:46053 IUPAC Name: 2-methyl-1,3,5-trinitrobenzene SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

p-Toluidine Hydrochloride 98.0+%, TCI America™

CAS: 540-23-8 Molecular Formula: C7H10ClN Molecular Weight (g/mol): 143.61 MDL Number: MFCD00035497 InChI Key: JQKBUTDZZRGQDR-UHFFFAOYSA-N PubChem CID: 10891 IUPAC Name: hydrogen 4-methylaniline chloride SMILES: [H+].[Cl-].CC1=CC=C(N)C=C1

4-Methoxy-2-methyldiphenylamine 97.0+%, TCI America™

CAS: 41317-15-1 Molecular Formula: C14H15NO Molecular Weight (g/mol): 213.28 MDL Number: MFCD00272619 InChI Key: CYMPUOGZUXAIMY-UHFFFAOYSA-N PubChem CID: 162461 IUPAC Name: 4-methoxy-2-methyl-N-phenylaniline SMILES: CC1=C(C=CC(=C1)OC)NC2=CC=CC=C2

p-Toluenesulfonyl cyanide, 95%, ACROS Organics™

CAS: 19158-51-1 Molecular Formula: C8H7NO2S Molecular Weight (g/mol): 181.21 InChI Key: JONIMGVUGJVFQD-UHFFFAOYSA-N Synonym: 4-methylbenzenesulfonyl cyanide, 4-methylphenyl sulfonylformonitrile, benzenesulfonyl cyanide, 4-methyl, benzenesulfonylcyanide, 4-methyl, p-toluene sulfonyl cyanide, p-toluenesulfonyl cyanide, p-toluenesulfonylcyanide, p-toluenesulphonyl cyanide, p-tolylsulfonyl cyanide, tosyl cyanide PubChem CID: 87946 IUPAC Name: (4-methylphenyl)sulfonylformonitrile SMILES: CC1=CC=C(C=C1)S(=O)(=O)C#N

p-Toluenesulfonyl chloride, 99+%, ACROS Organics™

CAS: 98-59-9 Molecular Formula: C7H7ClO2S Molecular Weight (g/mol): 190.65 InChI Key: YYROPELSRYBVMQ-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonyl chloride, 4-toluenesulfonyl chloride, p-toluenesulfochloride, p-toluenesulfonic acid chloride, p-toluenesulfonyl chloride, p-toluenesulphonyl chloride, p-tolylsulfonyl chloride, p-tosyl chloride, tosyl chloride, tosylchloride PubChem CID: 7397 IUPAC Name: 4-methylbenzenesulfonyl chloride SMILES: CC1=CC=C(C=C1)S(=O)(=O)Cl

N,N-Diethyl-m-toluamide 98.0+%, TCI America™

CAS: 134-62-3 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 MDL Number: MFCD00009046 InChI Key: MMOXZBCLCQITDF-UHFFFAOYSA-N Synonym: autan, deet, delphene, deta, detamide, dieltamid, diethyltoluamide, flypel, metadelphene, n,n-diethyl-m-toluamide PubChem CID: 4284 ChEBI: CHEBI:7071 IUPAC Name: N,N-diethyl-3-methylbenzamide SMILES: CCN(CC)C(=O)C1=CC(=CC=C1)C

Alfa Aesar™ 3-Bromo-5-methylaniline, 98%

CAS: 74586-53-1 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.052 MDL Number: MFCD11845553 InChI Key: YIZRPAWCIFTHNA-UHFFFAOYSA-N Synonym: 3-amino-5-bromotoluene, 3-bromo-5-methyl aniline, 3-bromo-5-methyl-aniline, 3-bromo-5-methylbenzenamine, 5-brom-3-toluidin, 5-bromo-m-toluidine, acmc-209ova, benzenamine, 3-bromo-5-methyl, ksc494e0l PubChem CID: 3018526 IUPAC Name: 3-bromo-5-methylaniline SMILES: CC1=CC(=CC(=C1)Br)N

2,4-Dimethylnitrobenzene 98.0+%, TCI America™

CAS: 89-87-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007169 InChI Key: BBUPBICWUURTNP-UHFFFAOYSA-N Synonym: 1,3-dimethyl-4-nitrobenzene, 1-nitro-2,4-dimethylbenzene, 2,4-dimethylnitrobenzene, 4-nitro-1,3-dimethylbenzene, 4-nitro-1,3-xylene, 4-nitro-m-xylene, benzene, 2,4-dimethyl-1-nitro, ccris 3120, m-xylene, 4-nitro, unii-7em84eue05 PubChem CID: 6991 IUPAC Name: 2,4-dimethyl-1-nitrobenzene SMILES: CC1=CC(=C(C=C1)[N+](=O)[O-])C

Alfa Aesar™ 2,5-Difluoro-3-nitrotoluene, 98%

CAS: 1093758-82-7 Molecular Formula: C7H5F2NO2 Molecular Weight (g/mol): 173.119 MDL Number: MFCD11519028 InChI Key: JPBHCSGGXITIHO-UHFFFAOYSA-N Synonym: 2,5-difluoro-3-nitrotoluene, 2,5-difluoro-nitrotoluene, pubchem10407 PubChem CID: 55274150 IUPAC Name: 2,5-difluoro-1-methyl-3-nitrobenzene SMILES: CC1=CC(=CC(=C1F)[N+](=O)[O-])F

Alfa Aesar™ o-Toluidine, 99%

CAS: 95-53-4 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00007730 InChI Key: RNVCVTLRINQCPJ-UHFFFAOYSA-N Synonym: 2-aminotoluene, 2-methylbenzenamine, 2-toluidine, benzenamine, 2-methyl, o-aminotoluene, o-methylaniline, o-methylbenzenamine, o-toluidine, o-tolylamine, ortho-toluidine PubChem CID: 7242 ChEBI: CHEBI:66892 IUPAC Name: 2-methylaniline SMILES: CC1=CC=CC=C1N

2-Fluoro-5-methylaniline 98.0+%, TCI America™

CAS: 452-84-6 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007654 InChI Key: QZUXMXZNVAJNSE-UHFFFAOYSA-N Synonym: 2-fluoro-5-methyl-aniline, 2-fluoro-5-methylbenzenamine, 2-fluoro-5-methylbenzeneamine, 2-fluoro-5-methylphenylamine, 2-fluoro-5-metylaniline, 3-amino-4-fluorotoluene, 6-fluoro-m-toluidine, acmc-209k1v, benzenamine, 2-fluoro-5-methyl, pubchem1507 PubChem CID: 262970 IUPAC Name: 2-fluoro-5-methylaniline SMILES: CC1=CC=C(F)C(N)=C1

1-(p-Tolyl)piperazine 98.0+%, TCI America™

CAS: 39593-08-3 Molecular Formula: C11H16N2 Molecular Weight (g/mol): 176.263 MDL Number: MFCD00040737 InChI Key: ONEYFZXGNFNRJH-UHFFFAOYSA-N Synonym: 1-4-methyl phenyl piperazine, 1-4-methyl-phenyl-piperazine, 1-4-methylphenyl piperazine, 1-4-methylphenyl-piperazine, 1-p-tolyl piperazine, 1-p-tolyl-piperazine, 1-p-tolylpiperazine, 4-4-methylphenyl piperazine, 4-methylphenyl piperazine, acmc-1adtx PubChem CID: 83113 IUPAC Name: 1-(4-methylphenyl)piperazine SMILES: CC1=CC=C(C=C1)N2CCNCC2

2,6-Dimethylnitrobenzene 99.0+%, TCI America™

CAS: 81-20-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007181 InChI Key: HDFQKJQEWGVKCQ-UHFFFAOYSA-N Synonym: 1,3-dimethyl-2-nitro-benzene, 2,6-dimethyl-1-nitrobenzene, 2,6-dimethylnitrobenzene, 2-nitro-m-xylene, benzene, 1,3-dimethyl-2-nitro, ccris 3119, dsstox_cid_5134, dsstox_gsid_25134, dsstox_rid_77678, m-xylene, 2-nitro PubChem CID: 6672 IUPAC Name: 1,3-dimethyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)C)[N+](=O)[O-]

5-Methoxy-2-methylaniline 98.0+%, TCI America™

CAS: 50868-72-9 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD00075057 InChI Key: RPJXLEZOFUNGNZ-UHFFFAOYSA-N Synonym: 2-amino-4-methoxytoluene, 2-methyl-5-ethoxyaniline, 3-amino-4-methylanisole 5-methoxy-2-methylaniline, 5-methoxy-2-methylbenzenamine, 5-methoxy-2-methylphenylamine, 5-methoxy-o-toluidine, 6-methyl-m-anisidine, acmc-1awic, benzenamine, 5-methoxy-2-methyl, pubchem19827 PubChem CID: 99500 IUPAC Name: 5-methoxy-2-methylaniline SMILES: COC1=CC=C(C)C(N)=C1

5-Amino-2-methylbenzenesulfonamide 98.0+%, TCI America™

CAS: 6973-09-7 Molecular Formula: C7H10N2O2S Molecular Weight (g/mol): 186.23 MDL Number: MFCD06681071 InChI Key: KTPBKMYOIFHJMI-UHFFFAOYSA-N Synonym: 2-methyl-5-aminobenzene sulfonamide, 3-amino-6-methylbenzenesulfonamide, 3-aminosulfonyl-4-methylaniline, 5-amino-2-methyl-benzenesulfonamide, 5-amino-2-methylbenzene-1-sulfonamide, acmc-1bcyh, benzenesulfonamide, 5-amino-2-methyl, ksc495k6b, p-aminotoluol-sulfonamid, pubchem14390 PubChem CID: 235511 IUPAC Name: 5-amino-2-methylbenzenesulfonamide SMILES: CC1=C(C=C(C=C1)N)S(=O)(=O)N

N,N-Dimethyl-p-toluidine, 99%, ACROS Organics™

CAS: 99-97-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00008316 InChI Key: GYVGXEWAOAAJEU-UHFFFAOYSA-N Synonym: 4,n,n-trimethylaniline, benzenamine, n,n,4-trimethyl, dimethyl-4-toluidine, dimethyl-p-toluidine, n,n,4-trimethylbenzenamine, n,n-dimethyl-4-methylaniline, n,n-dimethyl-p-toluidine, n,n-dimethyl-p-tolylamine, n,n-dimethyl-para-toluidine, p-dimethylamino toluene PubChem CID: 7471 IUPAC Name: N,N,4-trimethylaniline SMILES: CN(C)C1=CC=C(C)C=C1

4-Iodo-3-methylaniline, 98%, ACROS Organics™

CAS: 4949-69-3 Molecular Formula: C7H8IN Molecular Weight (g/mol): 233.05 MDL Number: MFCD01569451 InChI Key: UISBOJCPTKUBIC-UHFFFAOYSA-N Synonym: 2-iodo 5-aminotoluene, 3-methyl-4-iodoaniline, 4-iodo-3-methyl aniline, acmc-1ak0z, benzenamine,4-iodo-3-methyl PubChem CID: 2734275 IUPAC Name: 4-iodo-3-methylaniline SMILES: CC1=C(C=CC(=C1)N)I

o-Tolidine, Powder, Reagent, Spectrum™

CAS: 119-93-7 Molecular Formula: C14H16N2 Molecular Weight (g/mol): 212.30 InChI Key: NUIURNJTPRWVAP-UHFFFAOYSA-N IUPAC Name: 3,3'-dimethyl-[1,1'-biphenyl]-4,4'-diamine SMILES: CC1=CC(=CC=C1N)C1=CC=C(N)C(C)=C1

Tosylmethyl isocyanide, 98%, ACROS Organics™

CAS: 36635-61-7 Molecular Formula: C9H9NO2S Molecular Weight (g/mol): 195.24 MDL Number: MFCD00000005 InChI Key: CFOAUYCPAUGDFF-UHFFFAOYSA-N Synonym: 1-isocyanomethyl sulfonyl-4-methylbenzene, 1-isocyanomethylsulfonyl-4-methylbenzene, 4-toluenesulfonylmethyl isocyanide, 4-toluenesulphonylmethyl isocyanide, p-toluenesulfonylmethyl isocyanide, p-tolylsulfonyl methyl isocyanide, tosmic, tosylmethyl isocyanide, tosylmethylisocyanide, unii-c35fd6olh8 PubChem CID: 161915 IUPAC Name: 1-(isocyanomethylsulfonyl)-4-methylbenzene SMILES: CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-]

Alfa Aesar™ 2-Chloro-5-methylaniline, 98%

CAS: 95-81-8 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.60 MDL Number: MFCD00007674 InChI Key: HPSCXFOQUFPEPE-UHFFFAOYSA-N Synonym: 2-chlor-5-methyl-aniline, 2-chloro-5-methyl aniline, 2-chloro-5-methylbenzenamine, 2-chloro-5-methylphenylamine, 3-amino-4-chlorotoluene, 6-chlor-meta-toluidin, 6-chloro-m-toluidine, benzenamine, 2-chloro-5-methyl, ccris 2888, pubchem18921 PubChem CID: 66770 IUPAC Name: 2-chloro-5-methylaniline SMILES: CC1=CC=C(Cl)C(N)=C1

N-Methyl-4-nitro-o-toluidine 97.0+%, TCI America™

CAS: 10439-77-7 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00059083 InChI Key: NJYYBTRBCMPYCJ-UHFFFAOYSA-N Synonym: N,2-Dimethyl-4-nitroaniline, 2-(Methylamino)-5-nitrotoluene PubChem CID: 25282 IUPAC Name: N,2-dimethyl-4-nitroaniline SMILES: CNC1=CC=C(C=C1C)[N+]([O-])=O

Tolylene 2,6-diisocyanate, 97%, ACROS Organics™

CAS: 91-08-7 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.16 MDL Number: MFCD00002010 InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N Synonym: 2,6-diisocyanato-1-methylbenzene, 2,6-diisocyanatotoluene, 2,6-tdi, 2,6-toluene diisocyanate, 2-methyl-m-phenylene diisocyanate, benzene, 1,3-diisocyanato-2-methyl, m-tolylene diisocyanate, meta-tolylene diisocyanate, toluene 2,6-diisocyanate, toluene-2,6-diisocyanate PubChem CID: 7040 ChEBI: CHEBI:53557 IUPAC Name: 1,3-diisocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1N=C=O)N=C=O

2-Fluoro-4-methylaniline 97.0+%, TCI America™

CAS: 452-80-2 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00040975 InChI Key: ZQEXBVHABAJPHJ-UHFFFAOYSA-N Synonym: 2-fluoro-4-methyaniline, 2-fluoro-4-methyl aniline, 2-fluoro-4-methyl-aniline, 2-fluoro-4-methyl-phenylamine, 2-fluoro-4-methylphenylamine, 2-fluoro-p-toluidine, 4-amino-3-fluorotoluene, benzenamine, 2-fluoro-4-methyl, benzenamine, 2-fluoro-4-methyl-9ci, p-toluidine, 2-fluoro PubChem CID: 67984 IUPAC Name: 2-fluoro-4-methylaniline SMILES: CC1=CC=C(N)C(F)=C1

Dinitrodurene, 97%, ACROS Organics™

CAS: 5465-13-4 Molecular Formula: C10H12N2O4 Molecular Weight (g/mol): 224.22 InChI Key: AEPQXGFMAZTUEA-UHFFFAOYSA-N Synonym: 1,2,4,5-tetramethyl-3,6-dinitro-benzene, 1,4,5-tetramethyl-3,6-dinitrobenzene, 1,4-dinitro-2,3,5,6-tetramethylbenzene 97+%, 2,3,5,6-tetramethyl-p-dinitrobenzene, 3,2,4,5-tetramethylbenzene, benzene,2,4,5-tetramethyl-3,6-dinitro, dinitrotrodurene PubChem CID: 79593 IUPAC Name: 1,2,4,5-tetramethyl-3,6-dinitrobenzene SMILES: CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C

3-Methoxy-2-methylaniline 98.0+%, TCI America™

CAS: 19500-02-8 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD06412568 InChI Key: OPXLVWLFDKRYRB-UHFFFAOYSA-N Synonym: 1-Amino-3-methoxy-2-methylbenzene, 3-Methoxy-o-toluidine PubChem CID: 11804822 IUPAC Name: 3-methoxy-2-methylaniline SMILES: COC1=CC=CC(N)=C1C

3-Chloro-4-nitrotoluene, 98%, ACROS Organics™

CAS: 38939-88-7 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD02683043 InChI Key: KGSQRFPDZCBVBS-UHFFFAOYSA-N Synonym: 2-chloro-4-methyl-1-nitro-benzene, 3-chloro-4-nitrotoluene, acmc-1afh8, benzene, 2-chloro-4-methyl-1-nitro, ksc493s6j, pubchem4534 PubChem CID: 123478 IUPAC Name: 2-chloro-4-methyl-1-nitrobenzene SMILES: CC1=CC(=C(C=C1)[N+](=O)[O-])Cl

4-Bromo-3-methylaniline, 97%, ACROS Organics™

CAS: 6933-10-4 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00007828 InChI Key: MMEGELSFOYDPQW-UHFFFAOYSA-N Synonym: 3-methyl-4-bromoaniline, 4-bromo-3-methyl-aniline, 4-bromo-3-methyl-phenylamine, 4-bromo-3-methylbenzenamine, 4-bromo-3-methylphenylamine, 4-bromo-m-toluidine, 4-bromo3-methylaniline, 5-amino-2-bromotoluene, benzenamine, 4-bromo-3-methyl, pubchem4339 PubChem CID: 23359 IUPAC Name: 4-bromo-3-methylaniline SMILES: CC1=C(C=CC(=C1)N)Br

N-Methyl-p-toluidine 97.0+%, TCI America™

CAS: 623-08-5 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00025628 InChI Key: QCIFLGSATTWUQJ-UHFFFAOYSA-N Synonym: N,4-Dimethylaniline, 4-(Methylamino)toluene PubChem CID: 12165 IUPAC Name: N,4-dimethylaniline SMILES: CNC1=CC=C(C)C=C1

Alfa Aesar™ 2-Chloro-5-nitrotoluene, 98+%

CAS: 13290-74-9 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00041430 InChI Key: BGDCQZFFNFXYQC-UHFFFAOYSA-N Synonym: 1-chloro-2-methyl-4-nitro-benzene, 2-chloro-5-nitroluene, 2-chloro-5-nitrotoluene, 2-methyl-4-nitrochlorobenzene, 3-nitro-6-chlorotoluene, 4-chloro-3-methylnitrobenzene, 5-nitro-2-chlorotoluene, acmc-209bqf, benzene, 1-chloro-2-methyl-4-nitro, pubchem2137 PubChem CID: 83315 IUPAC Name: 1-chloro-2-methyl-4-nitrobenzene SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Alfa Aesar™ 3-Methyl-4-nitrobenzhydrazide, 97%

CAS: 72198-83-5 Molecular Formula: C8H9N3O3 Molecular Weight (g/mol): 195.18 MDL Number: MFCD00220059 InChI Key: SMRIMKXHORAHJR-UHFFFAOYSA-N Synonym: 2-methyl-1-nitrobenzene-4-carbohydrazide, 3-methyl-4-nitrobenzene-1-carbohydrazide, 3-methyl-4-nitrobenzhydrazide, 3-methyl-4-nitrobenzoylhydrazine, acmc-20an0k, benzoicacid, 3-methyl-4-nitro-, hydrazide, maybridge1_006277 PubChem CID: 3308571 IUPAC Name: 3-methyl-4-nitrobenzohydrazide SMILES: CC1=CC(=CC=C1[N+]([O-])=O)C(=O)NN

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