Benzenoids
4-Butoxybenzyl Alcohol 97.0+%, TCI America™
CAS: 6214-45-5 Molecular Formula: C11H16O2 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00004657 InChI Key: MGKNBDBZIKPUFM-UHFFFAOYSA-N Synonym: 4-butoxybenzyl alcohol,4-butoxyphenyl methanol,4-n-butoxybenzyl alcohol,p-butoxybenzyl alcohol,benzenemethanol, 4-butoxy,4-butoxybenzylalcohol,benzenemethanol,4-butoxy,4-butoxy-phenyl-methanol,4-butoxyphenyl methanol #,acmc-1b65d PubChem CID: 80346 IUPAC Name: (4-butoxyphenyl)methanol SMILES: CCCCOC1=CC=C(CO)C=C1
3-Nitrobenzyl Bromide 98.0+%, TCI America™
CAS: 3958-57-4 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007271 InChI Key: LNWXALCHPJANMJ-UHFFFAOYSA-N Synonym: 3-nitrobenzyl bromide,1-bromomethyl-3-nitrobenzene,m-nitrobenzyl bromide,benzene, 1-bromomethyl-3-nitro,alpha-bromo-3-nitrotoluene,m-bromomethyl nitrobenzene,alpha-bromo-m-nitrotoluene,m-nitro-alpha-bromotoluene,3-nitrobenzylbromide,toluene, alpha-bromo-m-nitro PubChem CID: 77568 IUPAC Name: 1-(bromomethyl)-3-nitrobenzene SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CBr
2-Fluorobenzyl Alcohol 97.0+%, TCI America™
CAS: 446-51-5 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00004601 InChI Key: QEHXDOJPVIHUDO-UHFFFAOYSA-N Synonym: 2-fluorobenzyl alcohol,2-fluorophenyl methanol,o-fluorobenzyl alcohol,benzenemethanol, 2-fluoro,2-fluorobenzylalcohol,2-fluoro-benzenemethanol,2-fluorobenzylic alcohol,2-fluorophenyl methan-1-ol,pubchem3485,acmc-1asq8 PubChem CID: 67969 IUPAC Name: (2-fluorophenyl)methanol SMILES: OCC1=CC=CC=C1F
4-(4-tert-Butylphenyl)benzoic Acid 98.0+%, TCI America™
CAS: 5748-42-5 Molecular Formula: C17H18O2 Molecular Weight (g/mol): 254.329 MDL Number: MFCD01631300 InChI Key: HZIOPONJCVOCFE-UHFFFAOYSA-N PubChem CID: 541479 IUPAC Name: 4-(4-tert-butylphenyl)benzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
4-tert-Butylphenyl Glycidyl Ether 98.0+%, TCI America™
CAS: 3101-60-8 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00005136 InChI Key: HHRACYLRBOUBKM-UHFFFAOYSA-N Synonym: p-tert-butylphenyl glycidyl ether,4-tert-butylphenyl glycidyl ether,4-t-butylphenyl glycidyl ether,2-4-tert-butylphenoxy methyl oxirane,tert-butylphenol glycidyl ether,tert-butylphenyl glycidyl ether,t-butyl phenyl glycidyl ether,ccris 2638,oxirane, 4-1,1-dimethylethyl phenoxy methyl,2-4-tert-butyl phenoxy methyl oxirane PubChem CID: 18360 IUPAC Name: 2-[(4-tert-butylphenoxy)methyl]oxirane SMILES: CC(C)(C)C1=CC=C(C=C1)OCC2CO2
2,4-Di-tert-amylphenol 98.0+%, TCI America™
CAS: 120-95-6 Molecular Formula: C16H26O Molecular Weight (g/mol): 234.38 MDL Number: MFCD00041929 InChI Key: WMVJWKURWRGJCI-UHFFFAOYSA-N Synonym: 2,4-di-tert-pentylphenol,2,4-di-tert-amylphenol,2,4-di-t-pentylphenol,2,4-bis 1,1-dimethylpropyl phenol,phenol, 2,4-bis 1,1-dimethylpropyl,di-tert-amylphenol,prodox 156,phenol, 2,4-di-tert-pentyl,2,4-bis 2-methylbutan-2-yl phenol,unii-852f1hp88h PubChem CID: 8455 IUPAC Name: 2,4-bis(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(O)C(=C1)C(C)(C)CC
3,4-Dihydroxy-5-nitrobenzaldehyde 98.0+%, TCI America™
CAS: 116313-85-0 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00871897 InChI Key: BBFJODMCHICIAA-UHFFFAOYSA-N PubChem CID: 5748957 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C=O
p-Tolyl Acetate 98.0+%, TCI America™
CAS: 140-39-6 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008703 InChI Key: CDJJKTLOZJAGIZ-UHFFFAOYSA-N Synonym: Acetic Acid p-Cresyl Ester, Acetic Acid p-Tolyl Ester, p-Cresyl Acetate PubChem CID: 8797 ChEBI: CHEBI:9627 IUPAC Name: 4-methylphenyl acetate SMILES: CC(=O)OC1=CC=C(C)C=C1
9-Aminoanthracene 96.0+%, TCI America™
CAS: 779-03-3 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.249 MDL Number: MFCD00452690 InChI Key: LHNICELDCMPPDE-UHFFFAOYSA-N Synonym: 9-Anthramine PubChem CID: 13069 ChEBI: CHEBI:50472 IUPAC Name: anthracen-9-amine SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2N
4-tert-Butyl-3-methoxy-2,6-dinitrotoluene 99.0+%, TCI America™
CAS: 83-66-9 Molecular Formula: C12H16N2O5 Molecular Weight (g/mol): 268.269 MDL Number: MFCD00024268 InChI Key: SUAUILGSCPYJCS-UHFFFAOYSA-N Synonym: 6-tert-Butyl-3-methyl-2,4-dinitroanisole PubChem CID: 6753 ChEBI: CHEBI:82495 IUPAC Name: 1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene SMILES: CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
2,3-Bis(2,6-diisopropylphenylimino)butane 98.0+%, TCI America™
CAS: 74663-77-7 Molecular Formula: C28H40N2 Molecular Weight (g/mol): 404.642 MDL Number: MFCD01862435 InChI Key: YUFQUBWPYIPRHZ-UHFFFAOYSA-N Synonym: N,N′-Bis(2,6-diisopropylphenyl)butane-2,3-diimine PubChem CID: 608871 IUPAC Name: 2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N=C(C)C(=NC2=C(C=CC=C2C(C)C)C(C)C)C
2-Amino-5-chlorobenzotrifluoride 98.0+%, TCI America™
CAS: 445-03-4 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.57 MDL Number: MFCD00007841 InChI Key: CVINWVPRKDIGLL-UHFFFAOYSA-N Synonym: 2-amino-5-chlorobenzotrifluoride,4-chloro-2-trifluoromethyl aniline,benzenamine, 4-chloro-2-trifluoromethyl,2-amino-5-chlorobenzo trifluoride,5-chloro-2-aminobenzotrifluoride,2-amino-5-chloro-trifluorotoluene,2-trifluoromethyl-4-chloro-aniline,2-trifluoromethyl-4-chloroaniline,4-chloro-alpha,alpha,alpha-trifluoro-o-toluidine,4-chloro-2-trifluoromethyl-phenylamine PubChem CID: 67961 IUPAC Name: 4-chloro-2-(trifluoromethyl)aniline SMILES: NC1=CC=C(Cl)C=C1C(F)(F)F
2-Bromo-4-methoxy-6-nitrophenol 98.0+%, TCI America™
CAS: 115929-59-4 Molecular Formula: C7H6BrNO4 Molecular Weight (g/mol): 248.032 MDL Number: MFCD06797984 InChI Key: GAVVLRJHVWIDPK-UHFFFAOYSA-N PubChem CID: 11265140 IUPAC Name: 2-bromo-4-methoxy-6-nitrophenol SMILES: COC1=CC(=C(C(=C1)[N+](=O)[O-])O)Br
trans-beta-Nitrostyrene 98.0+%, TCI America™
CAS: 5153-67-3 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00007402 InChI Key: PIAOLBVUVDXHHL-VOTSOKGWSA-N Synonym: trans-beta-nitrostyrene,2-nitrovinyl benzene,e-2-nitrovinyl benzene,beta-nitrostyrene,2-nitro-1-phenylethylene,e-beta-nitrostyrene,2-nitroethenyl benzene,1-phenyl-2-nitroethene,beta-nitrosytrene,benzene, 2-nitroethenyl PubChem CID: 5284459 IUPAC Name: [(1E)-2-nitroethenyl]benzene SMILES: [O-][N+](=O)\C=C\C1=CC=CC=C1
4-(Trifluoromethylthio)benzoic Acid 97.0+%, TCI America™
CAS: 330-17-6 Molecular Formula: C8H5F3O2S Molecular Weight (g/mol): 222.181 MDL Number: MFCD00040906 InChI Key: UMOGQQWVQUQTQA-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio benzoic acid,4-trifluoromethyl sulfanyl benzoic acid,4-trifluoromethyl thio benzoic acid,4-trifluoromethylsulfanyl-benzoic acid,4-trifluoromethylsulfanyl benzoic acid,4-trifluoromethyl-mercapto-benzoic acid,pubchem13674,acmc-209hxv,4-trifluoromethylthiobenzoic acid PubChem CID: 2777858 IUPAC Name: 4-(trifluoromethylsulfanyl)benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)SC(F)(F)F