Benzene and substituted derivatives
1-Benzyl-3-(ethylamino)pyrrolidine 96.0+%, TCI America™
CAS: 115445-21-1 Molecular Formula: C13H20N2 Molecular Weight (g/mol): 204.317 MDL Number: MFCD00191305 InChI Key: ZSIUSRJKSLXIJH-UHFFFAOYSA-N PubChem CID: 10330560 IUPAC Name: 1-benzyl-N-ethylpyrrolidin-3-amine SMILES: CCNC1CCN(C1)CC2=CC=CC=C2
2,6-Dibromo-4-(trifluoromethoxy)aniline 98.0+%, TCI America™
CAS: 88149-49-9 Molecular Formula: C7H4Br2F3NO Molecular Weight (g/mol): 334.92 MDL Number: MFCD00153113 InChI Key: JBSWOEGXMADXOU-UHFFFAOYSA-N Synonym: 2,6-dibromo-4-trifluoromethoxy aniline,bromo riluzole impurity,3,5-dibromo-4-aminotrifluoromethoxybenzene,2,6-dibromo-4-trifluoromethoxy benzenamine,2-amino-1,3-dibromo-5-trifluoromethoxy benzene,2,6dibromo-4-trifluoromethoxy aniline,2,6-dibromo-4-trifluoro-methoxy aniline,benzenamine, 2,6-dibromo-4-trifluoromethoxy,pubchem10031 PubChem CID: 2736797 IUPAC Name: 2,6-dibromo-4-(trifluoromethoxy)aniline SMILES: NC1=C(Br)C=C(OC(F)(F)F)C=C1Br
4-Fluoro-3-nitrotoluene 98.0+%, TCI America™
CAS: 446-11-7 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007060 InChI Key: OORBDHOQLZRIQR-UHFFFAOYSA-N Synonym: 4-fluoro-3-nitrotoluene,3-nitro-4-fluorotoluene,2-fluoro-5-methylnitrobenzene,4-methyl-2-nitro-1-fluorobenzene,1-fluoro-4-methyl-2-nitro-benzene,benzene, 1-fluoro-4-methyl-2-nitro,pubchem1597,acmc-1aqwi,4-fluro-3-nitrotoluene,4-fluoro-3-nitro toluene PubChem CID: 136287 IUPAC Name: 1-fluoro-4-methyl-2-nitrobenzene SMILES: CC1=CC(=C(C=C1)F)[N+](=O)[O-]
2,3-Difluorophenetole 98.0+%, TCI America™
CAS: 121219-07-6 Molecular Formula: C8H8F2O Molecular Weight (g/mol): 158.148 MDL Number: MFCD07368737 InChI Key: AVOGLGBKOFOSBN-UHFFFAOYSA-N Synonym: 1-Ethoxy-2,3-difluorobenzene PubChem CID: 2782928 IUPAC Name: 1-ethoxy-2,3-difluorobenzene SMILES: CCOC1=C(C(=CC=C1)F)F
3-Hydroxybenzyl Alcohol 99.0+%, TCI America™
CAS: 620-24-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00004643 InChI Key: OKVJCVWFVRATSG-UHFFFAOYSA-N Synonym: 3-hydroxybenzyl alcohol,3-hydroxymethyl phenol,benzenemethanol, 3-hydroxy,3-methylolphenol,m-hydroxybenzyl alcohol,3-hydroxybenzenemethanol,benzyl alcohol, m-hydroxy,3-hydroxybenzylalcohol,3-oh-benzyl-alcohol,3-hydroxymethyl-phenol PubChem CID: 102 ChEBI: CHEBI:17069 IUPAC Name: 3-(hydroxymethyl)phenol SMILES: C1=CC(=CC(=C1)O)CO
4-(Trifluoromethylthio)benzylamine 97.0+%, TCI America™
CAS: 128273-56-3 Molecular Formula: C8H8F3NS Molecular Weight (g/mol): 207.214 MDL Number: MFCD00190129 InChI Key: LACURGWEZCFLBO-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio benzylamine,4-trifluoromethyl thio phenyl methanamine,4-trifluoromethylsulfanyl phenyl methanamine,4-trifluoromethyl sulfanyl phenyl methanamine,1-4-trifluoromethyl thio phenyl methanamine,1-4-trifluoromethyl sulfanyl phenyl methanamine,acmc-1chvc,rarechem al bw 0450,4-trifluomethylthio benzylamine PubChem CID: 2777875 IUPAC Name: [4-(trifluoromethylsulfanyl)phenyl]methanamine SMILES: C1=CC(=CC=C1CN)SC(F)(F)F
4-Heptylbenzoic Acid 95.0+%, TCI America™
CAS: 38350-87-7 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00009722 InChI Key: VSUKEWPHURLYTK-UHFFFAOYSA-N Synonym: benzoic acid, 4-heptyl,4-n-heptylbenzoic acid,4-heptylbenzoicacid,4-heptylbenzoate,p-heptylbenzoic acid,acmc-209izm,4-n-heptyl-benzoic acid,4-heptylbenzoic acid PubChem CID: 170036 IUPAC Name: 4-heptylbenzoic acid SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)O
2,6-Difluorobenzyl Cyanide 98.0+%, TCI America™
CAS: 654-01-3 Molecular Formula: C8H5F2N Molecular Weight (g/mol): 153.13 MDL Number: MFCD00009973 InChI Key: GVAYBGQTAADLJS-UHFFFAOYSA-N Synonym: 2,6-difluorophenylacetonitrile,2-2,6-difluorophenyl acetonitrile,2,6-difluorobenzyl cyanide,2,6-difluorophenyl acetonitrile,2,6-difluorobenzeneacetonitrile,benzeneacetonitrile, 2,6-difluoro,2-2,6-difluorophenyl ethanenitrile,pubchem4152,acmc-1axnw,n-dodecyl-beta-maltoside PubChem CID: 69559 IUPAC Name: 2-(2,6-difluorophenyl)acetonitrile SMILES: FC1=CC=CC(F)=C1CC#N
Sodium p-Styrenesulfonate Hydrate 93.0+%, TCI America™
CAS: 123333-94-8 Molecular Formula: C8H9NaO4S Molecular Weight (g/mol): 224.21 MDL Number: MFCD03092905 InChI Key: AATHLPHPRXGBAI-UHFFFAOYSA-M Synonym: p-Styrenesulfonic Acid Sodium Salt PubChem CID: 23681144 IUPAC Name: sodium 4-ethenylbenzene-1-sulfonate hydrate SMILES: O.[Na+].[O-]S(=O)(=O)C1=CC=C(C=C)C=C1
2'-Methyl-3'-nitroacetanilide 98.0+%, TCI America™
CAS: 56207-36-4 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD01047363 InChI Key: NMYFXIITWKKOKY-UHFFFAOYSA-N PubChem CID: 151316 IUPAC Name: N-(2-methyl-3-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=CC(=C1C)[N+]([O-])=O
Methyl m-Anisate 98.0+%, TCI America™
CAS: 5368-81-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017193 InChI Key: DUKYPQBGYRJVAN-UHFFFAOYSA-N Synonym: methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester PubChem CID: 79332 IUPAC Name: methyl 3-methoxybenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1
4-Fluoro-3-(hydroxymethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 481681-02-1 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.95 MDL Number: MFCD08235075 InChI Key: PWMOQHMTXJYUGE-UHFFFAOYSA-N Synonym: 4-fluoro-3-hydroxymethyl phenyl boronic acid,4-fluoro-3-hydroxymethyl phenylboronic acid,4-fluoro-3-hydroxymethyl benzeneboronic acid,4-fluoro-3-hydroxymethylphenylboronic acid,boronic acid, 4-fluoro-3-hydroxymethyl phenyl,boronic acid,b-4-fluoro-3-hydroxymethyl phenyl,pubchem23767,acmc-209kcj,ksc496e1t PubChem CID: 21865588 IUPAC Name: [4-fluoro-3-(hydroxymethyl)phenyl]boronic acid SMILES: OCC1=C(F)C=CC(=C1)B(O)O
2-Chloro-5-hydroxybenzotrifluoride 98.0+%, TCI America™
CAS: 6294-93-5 Molecular Formula: C7H4ClF3O Molecular Weight (g/mol): 196.55 MDL Number: MFCD00042525 InChI Key: ZLFPIEUWXNRPNM-UHFFFAOYSA-N Synonym: 4-chloro-3-trifluoromethyl phenol,2-chloro-5-hydroxybenzotrifluoride,phenol, 4-chloro-3-trifluoromethyl,4-chloro-3-trifluoromethyl-phenol,phenol, p-chloro-m-trifluoromethyl,p-chloro-m-trifluoromethylphenol,2-chloro-5-hydroxybezotrifluoride,pubchem2863 PubChem CID: 80520 IUPAC Name: 4-chloro-3-(trifluoromethyl)phenol SMILES: OC1=CC=C(Cl)C(=C1)C(F)(F)F
3-Methyl-4-nitroaniline 97.0+%, TCI America™
CAS: 611-05-2 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 InChI Key: XPAYEWBTLKOEDA-UHFFFAOYSA-N Synonym: 4-nitro-m-toluidine,benzenamine, 3-methyl-4-nitro,3-methyl-4-nitro-aniline,3-methyl-4-nitro-phenylamine,3-methyl-4-nitrophenylamine,4-nitro-m-toluidin,3-methyl4-nitroaniline,pubchem12456,3-mehtyl-4-nitroanilin,5-amino-2-nitrotoluene PubChem CID: 11898 IUPAC Name: 3-methyl-4-nitroaniline SMILES: CC1=C(C=CC(=C1)N)[N+](=O)[O-]
2-Hydroxy-4-methoxybenzophenone-5-sulfonic Acid Hydrate (contains 5-10% Isopropyl Alcohol) 98.0+%, TCI America™
CAS: 4065-45-6 Molecular Formula: C14H12O6S Molecular Weight (g/mol): 308.30 MDL Number: MFCD00024962 InChI Key: CXVGEDCSTKKODG-UHFFFAOYSA-N Synonym: sulisobenzone,benzophenone-4,sungard,2-hydroxy-4-methoxybenzophenone-5-sulfonic acid,benzophenone 4,uval,uvinul,benzenesulfonic acid, 5-benzoyl-4-hydroxy-2-methoxy,sulisobenzona,sulisobenzonum PubChem CID: 19988 IUPAC Name: 5-benzoyl-4-hydroxy-2-methoxybenzene-1-sulfonic acid SMILES: COC1=CC(O)=C(C=C1S(O)(=O)=O)C(=O)C1=CC=CC=C1