Benzenoids
5-Phenyl-2,4-pentadienoic acid, 98+%
CAS: 1552-94-9 Molecular Formula: C11H10O2 Molecular Weight (g/mol): 174.199 MDL Number: MFCD00014018 InChI Key: FEIQOMCWGDNMHM-KBXRYBNXSA-N Synonym: 5-phenylpenta-2,4-dienoic acid,2e,4e-5-phenylpenta-2,4-dienoic acid,5-phenyl-2,4-pentadienoic acid,2,4-pentadienoic acid, 5-phenyl,e,e-cinnamylideneacetic acid,2e,4e-5-phenyl-2,4-pentadienoic acid,2,4-pentadienoicacid, 5-phenyl-, 2e,4e,4-phenyl-1,3-butadiene-1-carboxylic acid,juarezic acid,cinnamylidene acetic acid PubChem CID: 1549512 IUPAC Name: (2E,4E)-5-phenylpenta-2,4-dienoic acid SMILES: C1=CC=C(C=C1)C=CC=CC(=O)O
1-Propionylpyrene, 98%, Thermo Scientific™
CAS: 500004-32-0 Molecular Formula: C19H14O Molecular Weight (g/mol): 258.31 InChI Key: COIWAOXGROSMQJ-UHFFFAOYSA-N PubChem CID: 232861 IUPAC Name: 1-pyren-1-ylpropan-1-one SMILES: CCC(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1
1-Bromo-2,4-dimethoxybenzene, 98%, Thermo Scientific™
CAS: 17715-69-4 Molecular Formula: C8H9BrO2 Molecular Weight (g/mol): 217.06 MDL Number: MFCD00009844 InChI Key: NIUZVSQOXJIHBL-UHFFFAOYSA-N Synonym: 2,4-dimethoxybromobenzene,1,3-dimethoxy-4-bromobenzene,4-bromo-3-methoxyanisole,benzene, 1-bromo-2,4-dimethoxy,4-bromoresorcinol dimethyl ether,4-bromoresocinol dimethyl ether,4-bromo-1,3-dimethoxybenzene,1-brom-2,4-dimethoxybenzol,pubchem3036,acmc-1c5dw PubChem CID: 87266 IUPAC Name: 1-bromo-2,4-dimethoxybenzene SMILES: COC1=CC=C(Br)C(OC)=C1
3-Fluoro-5-(trifluoromethyl)phenyl isocyanate, Thermo Scientific™
CAS: 302912-19-2 Molecular Formula: C8H3F4NO Molecular Weight (g/mol): 205.112 InChI Key: WGSXKYXKAARAKD-UHFFFAOYSA-N Synonym: 3-fluoro-5-trifluoromethyl phenyl isocyanate,1-fluoro-3-isocyanato-5-trifluoromethyl benzene,3-fluoro-5-trifluoromethyl phenyl,3-fluoro-5-trifluoromethylphenylisocyanate,3-fluoro-5-trifluoromethylphenyl isocyanate,3-fluoro-5-trifluoromethyl phenylisocyanate,5-fluoro-3-trifluoromethyl benzenisocyanate,3-fluoro-5-trifluoromethyl-phenylisocyanate,benzene,1-fluoro-3-isocyanato-5-trifluoromethyl PubChem CID: 3445672 IUPAC Name: 1-fluoro-3-isocyanato-5-(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1N=C=O)F)C(F)(F)F
5-Bromo-1-(phenylsulfonyl)-1H-indole, 97%, Thermo Scientific™
CAS: 118757-11-2 Molecular Formula: C14H10BrNO2S Molecular Weight (g/mol): 336.20 MDL Number: MFCD03086087 InChI Key: XUKSXJWRFMTAPZ-UHFFFAOYSA-N Synonym: 5-bromo-1-phenylsulfonyl-1h-indole,5-bromo-1-phenylsulfonyl indole,1-benzenesulfonyl-5-bromoindole,5-bromo-1-phenylsulphonyl-1h-indole,1-phenylsulfonyl-5-bromoindole,5-bromo-1-phenylsulfonylindole,1-benzenesulfonyl-5-bromo-1h-indole,1-phenylsulfonyl-5-bromo-1h-indole PubChem CID: 2776210 IUPAC Name: 1-(benzenesulfonyl)-5-bromoindole SMILES: BrC1=CC=C2N(C=CC2=C1)S(=O)(=O)C1=CC=CC=C1
2-Cyanobenzoic acid, 94%
CAS: 3839-22-3 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00045796 InChI Key: DTNSDCJFTHMDAK-UHFFFAOYSA-N Synonym: o-cyanobenzoic acid,cyanobenzoic acid,benzoic acid, 2-cyano,2-carboxybenzonitrile,2-carboxy-benzonitrile,2-cyanobenzoicacid,2-cyano-benzoic acid,pubchem12513,acmc-1bn2v PubChem CID: 138061 IUPAC Name: 2-cyanobenzoic acid SMILES: C1=CC=C(C(=C1)C#N)C(=O)O
4-Methoxytrityl alcohol, 94%
CAS: 847-83-6 Molecular Formula: C20H18O2 Molecular Weight (g/mol): 290.36 MDL Number: MFCD00087962 InChI Key: WCRRRAKYYPJJMP-UHFFFAOYSA-N Synonym: p-methoxytrityl alcohol,4-methoxyphenyl diphenylmethanol,unii-d117s0gbot,4-methoxytrityl alcohol,p-methoxyphenyl-diphenylmethanol,p-anisyldiphenylmethanol,d117s0gbot,4-methoxyphenyldiphenylmethanol,methoxytriphenylcarbinole PubChem CID: 70061 IUPAC Name: (4-methoxyphenyl)-diphenylmethanol SMILES: COC1=CC=C(C=C1)C(O)(C1=CC=CC=C1)C1=CC=CC=C1
4-Fluorobenzyl bromide, 97%
CAS: 459-46-1 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.03 MDL Number: MFCD00000359 InChI Key: NVNPLEPBDPJYRZ-UHFFFAOYSA-N Synonym: 4-fluorobenzyl bromide,1-bromomethyl-4-fluorobenzene,p-fluorobenzyl bromide,4-fluorobenzylbromide,benzene, 1-bromomethyl-4-fluoro,alpha-bromo-p-fluorotoluene,alpha-bromo-4-fluorotoluene,1-bromomethyl-4-fluoro-benzene,4-bromomethyl-1-fluorobenzene,para-fluorobenzyl bromide PubChem CID: 68021 IUPAC Name: 1-(bromomethyl)-4-fluorobenzene SMILES: FC1=CC=C(CBr)C=C1
4,4'-Sulfonyldiphenol, 99.7%
CAS: 80-09-1 Molecular Formula: C12H10O4S Molecular Weight (g/mol): 250.27 MDL Number: MFCD00002350 InChI Key: VPWNQTHUCYMVMZ-UHFFFAOYSA-N Synonym: 4,4'-sulfonyldiphenol,bisphenol s,bis 4-hydroxyphenyl sulfone,phenol, 4,4'-sulfonylbis,4,4'-dihydroxydiphenyl sulfone,4-hydroxyphenyl sulfone,bis p-hydroxyphenyl sulfone,4,4'-sulfonylbisphenol,diphone c PubChem CID: 6626 ChEBI: CHEBI:34372 IUPAC Name: 4-(4-hydroxyphenyl)sulfonylphenol SMILES: OC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(O)C=C1
4-Isopropylphenol, 98%
CAS: 99-89-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00002372 InChI Key: YQUQWHNMBPIWGK-UHFFFAOYSA-N Synonym: 4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol PubChem CID: 7465 IUPAC Name: 4-propan-2-ylphenol SMILES: CC(C)C1=CC=C(C=C1)O
Methyl 2-iodobenzoate, 99+%
CAS: 610-97-9 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.04 MDL Number: MFCD00016351 InChI Key: BXXLTVBTDZXPTN-UHFFFAOYSA-N Synonym: 2-iodobenzoic acid methyl ester,methyl o-iodobenzoate,methyl-2-iodobenzoate,benzoic acid, 2-iodo-, methyl ester,2-iodo-benzoic acid methyl ester,methyl2-iodobenzoate,benzoic acid, o-iodo-, methyl ester,methyl 2-iodo-benzoate,pubchem10568,acmc-209mp0 PubChem CID: 69132 IUPAC Name: methyl 2-iodobenzoate SMILES: COC(=O)C1=CC=CC=C1I
4-Bromophenylacetonitrile, 99%
CAS: 16532-79-9 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001916 InChI Key: MFHFWRBXPQDZSA-UHFFFAOYSA-N Synonym: 4-bromophenylacetonitrile,4-bromobenzyl cyanide,2-4-bromophenyl acetonitrile,benzeneacetonitrile, 4-bromo,p-bromophenylacetonitrile,4-bromobenzylcyanide,4-bromobenzeneacetonitrile,p-bromobenzyl cyanide,p-bromobenzylcyanide,acetonitrile, p-bromophenyl PubChem CID: 27914 IUPAC Name: 2-(4-bromophenyl)acetonitrile SMILES: BrC1=CC=C(CC#N)C=C1
2-(Trifluoromethyl)benzoic acid, 98%, Thermo Scientific Chemicals
CAS: 433-97-6 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.12 MDL Number: MFCD00002476 InChI Key: FBRJYBGLCHWYOE-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzoic acid,o-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-o-toluic acid,o-carboxybenzotrifluoride,2-carboxybenzotrifluoride,unii-0r1ck7mzua,trifluoromethylbenzoic acid,2-trifluoromethyl benzoate,2-trifluromethylbenzoic acid,trifluoromethyl benzoic acid PubChem CID: 9899 ChEBI: CHEBI:60694 IUPAC Name: 2-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=CC=CC=C1C(F)(F)F
(S)-(+)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 99%
CAS: 20445-33-4 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00067105 InChI Key: PAORVUMOXXAMPL-SECBINFHSA-N Synonym: s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,+-mtpa-cl,unii-472va70ul4,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,s-+-a-methoxy-a-trifluoromethylphenylacetyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetylchloride,s-+-alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,+-mtpa chloride,+-mosher's chloride PubChem CID: 2724611 IUPAC Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: COC(C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F
Ethyl 4-bromobenzoate, 99%
CAS: 5798-75-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00016329 InChI Key: XZIAFENWXIQIKR-UHFFFAOYSA-N Synonym: 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate PubChem CID: 22043 IUPAC Name: ethyl 4-bromobenzoate SMILES: CCOC(=O)C1=CC=C(Br)C=C1