Benzene and substituted derivatives
3-Bromo-4-fluorobenzyl bromide, 97%
CAS: 78239-71-1 Molecular Formula: C7H5Br2F Molecular Weight (g/mol): 267.92 MDL Number: MFCD09037367 InChI Key: ZRWSODQPUJMFRV-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorobenzyl bromide,2-bromo-4-bromomethyl-1-fluorobenzene,3-bromo-4-fluorobenzylbromide,benzene, 2-bromo-4-bromomethyl-1-fluoro,2-bromanyl-4-bromomethyl-1-fluoranyl-benzene,pubchem24015,acmc-209pdt,3-bromo-4-fluoro-benzyl bromide,2-bromo-4-bromomethyl-1-fluoro-benzene,benzene,2-bromo-4-bromomethyl-1-fluoro PubChem CID: 12922710 IUPAC Name: 2-bromo-4-(bromomethyl)-1-fluorobenzene SMILES: FC1=C(Br)C=C(CBr)C=C1
p-Toluenesulfonyl semicarbazide, 95%
CAS: 10396-10-8 Molecular Formula: C8H11N3O3S Molecular Weight (g/mol): 229.254 MDL Number: MFCD00072243 InChI Key: VRFNYSYURHAPFL-UHFFFAOYSA-N Synonym: p-toluenesulfonylsemicarbazide,1-tosylsemicarbazide,p-toluenesulfonyl semicarbazide,benzenesulfonic acid, 4-methyl-, 2-aminocarbonyl hydrazide,1-p-methylphenylsulfonyl semicarbazide,4-methylbenzenesulfonamidourea,p-toluenesulfohyl semicarbazide,4-methylbenzenesulfonamido urea,4-toluenesulfonyl semicarbazide,ra ptss PubChem CID: 82602 IUPAC Name: [(4-methylphenyl)sulfonylamino]urea SMILES: CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)N
4-(2-Cyano-2-propyl)benzeneboronic acid, 97%, Thermo Scientific™
CAS: 850568-67-1 Molecular Formula: C10H12BNO2 Molecular Weight (g/mol): 189.021 MDL Number: MFCD06659832 InChI Key: BNXBFDTWYHAEIR-UHFFFAOYSA-N Synonym: 2-4-boronophenyl-2-methylpropanenitrile,4-2-cyanopropan-2-yl phenylboronic acid,4-1-cyano-1-methylethyl phenyl boronic acid,2-4-boronophenyl-2-methylpropionitrile,4-2-cyanopropan-2-yl benzeneboronic acid,4-2-cyanopropan-2-yl phenyl boronic acid,4-1-cyano-1-methylethyl phenylboronic acid,4-2-cyanoprop-2-yl benzeneboronic acid,boronic acid, 4-1-cyano-1-methylethyl phenyl PubChem CID: 44119324 IUPAC Name: [4-(2-cyanopropan-2-yl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)C(C)(C)C#N)(O)O
4-Fluoro-2-nitrobenzaldehyde, 98%
CAS: 2923-96-8 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.11 MDL Number: MFCD01666439 InChI Key: ORCGMGUNVGVHDN-UHFFFAOYSA-N Synonym: 4-fluoro-2-nitro-benzaldehyde,benzaldehyde, 4-fluoro-2-nitro,pubchem15643,acmc-1chrz,wln: wnr cf fvh,2-nitro-4-fluorobenzaldehyde,ksc494k6p,4-fluoro-2-nitro benzaldehyde PubChem CID: 76226 IUPAC Name: 4-fluoro-2-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC(F)=CC=C1C=O
N-methyl-N-(2-phenoxybenzyl)amine, Thermo Scientific™
CAS: 361394-74-3 Molecular Formula: C14H15NO Molecular Weight (g/mol): 213.28 InChI Key: IMIUMEQDSKHKST-UHFFFAOYSA-N Synonym: n-methyl-2-phenoxybenzylamine,n-methyl-1-2-phenoxyphenyl methanamine,n-methyl-n-2-phenoxybenzyl amine,methyl 2-phenoxyphenyl methyl amine,benzenemethanamine, n-methyl-2-phenoxy,n-methyl-2-phenoxybenzenemethanamine,n-methyl-n-2-phenoxy benzylamine,n-methyl-1-2-phenoxyphenyl ;methanamine,n-methyl-1-2-phenoxyphenyl methanamine hydrochloride PubChem CID: 23512750 IUPAC Name: N-methyl-1-(2-phenoxyphenyl)methanamine SMILES: CNCC1=CC=CC=C1OC2=CC=CC=C2
Bis(2-aminophenyl) ether, 98%
CAS: 24878-25-9 Molecular Formula: C12H12N2O Molecular Weight (g/mol): 200.241 MDL Number: MFCD00792533 InChI Key: GOJFAKBEASOYNM-UHFFFAOYSA-N Synonym: 2,2'-oxydianiline,2-2-aminophenoxy aniline,2,2 inverted exclamation marka-oxydianiline,aminophenyl ether,o,o'-oxydianiline,2-aminophenyl ether,bis 2-aminophenyl ether,2,2'-oxybis benzenamine,benzenamine,2,2'-oxybis,2,2'-diaminodiphenyl ether PubChem CID: 458824 IUPAC Name: 2-(2-aminophenoxy)aniline SMILES: C1=CC=C(C(=C1)N)OC2=CC=CC=C2N
2-(4-tert-Butylphenyl)ethanol, 96%
CAS: 5406-86-0 Molecular Formula: C12H18O Molecular Weight (g/mol): 178.275 MDL Number: MFCD00236023 InChI Key: NZGMMENPUKHODD-UHFFFAOYSA-N Synonym: 2-4-tert-butylphenyl ethanol,2-4-tert-butyl phenyl ethanol,p-tert-butylphenethyl alcohol,p-tert-butyl phenethyl alcohol,phenethyl alcohol, p-tert-butyl,4-tert-butylphenethyl alcohol,unii-aes74i7nru,aes74i7nru,benzeneethanol, 4-1,1-dimethylethyl PubChem CID: 79410 IUPAC Name: 2-(4-tert-butylphenyl)ethanol SMILES: CC(C)(C)C1=CC=C(C=C1)CCO
5-tert-Butyl-2-methoxybenzeneboronic acid, 98+%, Thermo Scientific Chemicals
CAS: 128733-85-7 Molecular Formula: C11H17BO3 Molecular Weight (g/mol): 208.064 MDL Number: MFCD06201034 InChI Key: LXFOJKCQSAYVMF-UHFFFAOYSA-N Synonym: 5-tert-butyl-2-methoxyphenyl boronic acid,5-t-butyl-2-methoxyphenylboronic acid,5-tert-butyl-2-methoxybenzeneboronic acid,2-borono-4-tert-butyl anisole,acmc-1c4zr,2-methoxy-5-tert-butylphenylboronic acid,5-tert-butyl-2-methoxyphenyl boronicacid,boronic acid, b-5-1,1-dimethylethyl-2-methoxyphenyl PubChem CID: 14740579 IUPAC Name: (5-tert-butyl-2-methoxyphenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)C(C)(C)C)OC)(O)O
4-Iodophenylhydrazine, 95%
CAS: 13116-27-3 Molecular Formula: C6H7IN2 Molecular Weight (g/mol): 234.04 MDL Number: MFCD00052688 InChI Key: IQMLCMKMSBMMGR-UHFFFAOYSA-N Synonym: 4-iodophenyl hydrazine,1-4-iodophenyl hydrazine,4-iodo-phenyl-hydrazine,4-iodo phenyl hydrazine,p-iodophenyl-hydrazine,4-iodophenyl diazane,pubchem15797,acmc-1brf1,1-hydrazino-4-iodobenzene,4-iodophenylhydrazine PubChem CID: 704591 IUPAC Name: (4-iodophenyl)hydrazine SMILES: C1=CC(=CC=C1NN)I
3-Iodophenylacetonitrile, 97%
CAS: 130723-54-5 Molecular Formula: C8H6IN Molecular Weight (g/mol): 243.05 MDL Number: MFCD00040890 InChI Key: LVOKGAHCTHNWIL-UHFFFAOYSA-N Synonym: 3-iodophenylacetonitrile,2-3-iodophenyl acetonitrile,3-iodobenzyl cyanide,3-iodophenyl acetonitrile,m-iodobenzyl cyanide,3-iodophenyacetonitrile,pubchem12771,3-iodo-1-phenylacetonitrile,acmc-1c0v0,benzeneacetonitrile, 3-iodo PubChem CID: 2759368 IUPAC Name: 2-(3-iodophenyl)acetonitrile SMILES: IC1=CC=CC(CC#N)=C1
2-Chloro-5-(trifluoromethyl)phenylacetic acid, 97%
CAS: 22893-39-6 Molecular Formula: C9H6ClF3O2 Molecular Weight (g/mol): 238.59 MDL Number: MFCD01631471 InChI Key: PDKWZFJSOMUXLE-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl phenylacetic acid,2-2-chloro-5-trifluoromethyl phenyl acetic acid,2-chloro-5-trifluoromethyl phenyl acetic acid,pubchem7160,acmc-20anz9,2-chloro-5-trifluoromethyl-phenyl-acetic acid,benzeneacetic acid, 2-chloro-5-trifluoromethyl PubChem CID: 2778119 IUPAC Name: 2-[2-chloro-5-(trifluoromethyl)phenyl]acetic acid SMILES: OC(=O)CC1=CC(=CC=C1Cl)C(F)(F)F
Triclosan, USP, 97-103%, Spectrum™ Chemical
CAS: 3380-34-5 Molecular Formula: C12H7Cl3O2 Molecular Weight (g/mol): 289.54 InChI Key: XEFQLINVKFYRCS-UHFFFAOYSA-N IUPAC Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol SMILES: OC1=CC(Cl)=CC=C1OC1=CC=C(Cl)C=C1Cl
3-Phenoxytoluene, 97%
CAS: 3586-14-9 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.24 MDL Number: MFCD00008531 InChI Key: UDONPJKEOAWFGI-UHFFFAOYSA-N Synonym: 3-phenoxytoluene,3-methyldiphenyl ether,m-phenoxytoluene,phenyl m-tolyl ether,ether, phenyl m-tolyl,benzene, 1-methyl-3-phenoxy,m-methylphenyl phenyl ether,3-methylphenyl phenyl ether,unii-2zzi1z67wr PubChem CID: 19165 IUPAC Name: 1-methyl-3-phenoxybenzene SMILES: CC1=CC=CC(OC2=CC=CC=C2)=C1
2-Phenoxybenzoic acid, 98%
CAS: 2243-42-7 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00002429 InChI Key: PKRSYEPBQPFNRB-UHFFFAOYSA-N Synonym: o-phenoxybenzoic acid,benzoic acid, 2-phenoxy,benzoic acid, o-phenoxy,phenoxybenzoic acid,ortho-phenoxybenzoic acid,2-phenoxybenzoicacid,2-carboxydiphenyl ether,2-phenoxy-benzoic acid,o-phenoxybenzoic acid,o-carboxydiphenyl ether PubChem CID: 75237 ChEBI: CHEBI:72636 IUPAC Name: 2-phenoxybenzoic acid SMILES: C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)O
3-Phenoxybenzyl chloride, 97%
CAS: 53874-66-1 Molecular Formula: C13H11ClO Molecular Weight (g/mol): 218.68 MDL Number: MFCD00040866 InChI Key: QUYVTGFWFHQVRO-UHFFFAOYSA-N Synonym: 3-phenoxybenzyl chloride,1-chloromethyl-3-phenoxybenzene,m-phenoxybenzyl chloride,benzene, 1-chloromethyl-3-phenoxy,3-phenoxyphenylmethyl chloride,3-phenoxybenzylchloride,3-chloromethyl-1-phenoxybenzene,1-chlormethyl-3-phenoxybenzol,acmc-1asdb,m-phenoxy-benzyl chloride PubChem CID: 93291 IUPAC Name: 1-(chloromethyl)-3-phenoxybenzene SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)CCl