Benzene and substituted derivatives
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
Ethyl 4-(trifluoromethyl)benzoate, 99%
CAS: 583-02-8 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD00013563 InChI Key: ZQDADDSPMCHZPX-UHFFFAOYSA-N Synonym: ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester PubChem CID: 521827 IUPAC Name: ethyl 4-(trifluoromethyl)benzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C(F)(F)F
4-Methoxyphenyl chloroformate, 98%
CAS: 7693-41-6 Molecular Formula: C8H7ClO3 Molecular Weight (g/mol): 186.591 MDL Number: MFCD00013258 InChI Key: CCFSGQKTSBIIHG-UHFFFAOYSA-N Synonym: 4-methoxyphenyl chloroformate,carbonochloridic acid, 4-methoxyphenyl ester,4-methoxyphenylchloroformate,chloroformic acid 4-methoxyphenyl ester,acmc-1bfyr,p-methoxyphenyl chloroformate,4-methoxy-phenyl chloroformate,4-methoxy phenyl chloroformate,4-methoxyphenyl carbonochloridate PubChem CID: 82128 IUPAC Name: (4-methoxyphenyl) carbonochloridate SMILES: COC1=CC=C(C=C1)OC(=O)Cl
Leucovorin Calcium, USP, 95-105%, Spectrum™ Chemical
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L IUPAC Name: calcium (2S)-2-[(4-{[(2-amino-5-formyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioate SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
5-Fluoro-2-methoxybenzaldehyde, 98%
CAS: 19415-51-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00143458 InChI Key: CRLDWFVRQNUUSZ-UHFFFAOYSA-N PubChem CID: 2734943 IUPAC Name: 5-fluoro-2-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)F)C=O
2,5-Dimethoxybenzoic acid, 98+%
CAS: 2785-98-0 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00002436 InChI Key: NYJBTJMNTNCTCP-UHFFFAOYSA-N Synonym: benzoic acid, 2,5-dimethoxy,6-methoxy-m-anisic acid,2,5-dimethoxy-benzoic acid,2,5-dimethoxybenzoicacid,pubchem14413,acmc-1cit0,2,5-dimethoxybenzoic acid PubChem CID: 76027 IUPAC Name: 2,5-dimethoxybenzoic acid SMILES: COC1=CC(=C(C=C1)OC)C(=O)O
Methyl 4-fluoro-3-nitrobenzoate, 98%
CAS: 329-59-9 Molecular Formula: C8H6FNO4 Molecular Weight (g/mol): 199.14 MDL Number: MFCD00196161 InChI Key: CNJJSTPBUHAEFH-UHFFFAOYSA-N Synonym: methyl 4-fluoro-3-nitro-benzoate,4-fluoro-3-nitrobenzoic acid methyl ester,4-fluoro-3-nitro-benzoic acid methyl ester,benzoic acid, 4-fluoro-3-nitro-, methyl ester,pubchem2045,acmc-209hxf,methyl 4-fluoro-3 nitrobenzoate,4-carbomethoxy-2-nitrofluorobenzene,methyl4-fluoro-3-nitrobenzoate PubChem CID: 5219721 IUPAC Name: methyl 4-fluoro-3-nitrobenzoate SMILES: COC(=O)C1=CC(=C(F)C=C1)[N+]([O-])=O
6-Acetyl-2(3H)-benzoxazolone, 97%, Thermo Scientific Chemicals
CAS: 54903-09-2 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD01664312 InChI Key: QXBNAXVXLAHDTE-UHFFFAOYSA-N Synonym: 6-acetyl-2 3h-benzoxazolone,2 3h-benzoxazolone, 6-acetyl,jpb 2,6-acetyl-2-benzoxazolinone,6-acetylbenzo d oxazol-2 3h-one,6-acetyl-2,3-dihydro-1,3-benzoxazol-2-one,acetyl-6 benzoxazolinone french,6-acetyl-3h-benzooxazol-2-one,6-acetyl-1,3-benzoxazol-2 3h-one,6-acetyl-2-oxo-3-hydrobenzoxazole PubChem CID: 689054 IUPAC Name: 6-acetyl-3H-1,3-benzoxazol-2-one SMILES: CC(=O)C1=CC2=C(C=C1)NC(=O)O2
3-Amino-4-methylbiphenyl, 98%
CAS: 80938-67-6 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.25 MDL Number: MFCD00270126 InChI Key: YLKSTPDTTKOSIL-UHFFFAOYSA-N Synonym: 5-phenyl-o-toluidine,3-amino-4-methylbiphenyl,4-methyl-1,1'-biphenyl-3-amine,2-methyl-5-phenylphenylamine,1,1'-biphenyl-3-amine, 4-methyl,4-methylbiphenyl-3-amine,2-methyl-5-phenyl-aniline PubChem CID: 149880 IUPAC Name: 2-methyl-5-phenylaniline SMILES: CC1=CC=C(C=C1N)C1=CC=CC=C1
Potassium 4-iodophenyltrifluoroborate, 96%
CAS: 912350-00-6 Molecular Formula: C6H4BF3IK Molecular Weight (g/mol): 309.906 MDL Number: MFCD09800738 InChI Key: WTXNSBOVCAXUGV-UHFFFAOYSA-N Synonym: potassium 4-iodophenyltrifluoroborate,potassium trifluoro 4-iodophenyl boranuide,amtb080,potassium trifluoro 4-iodophenyl borate 1- PubChem CID: 23688160 IUPAC Name: potassium;trifluoro-(4-iodophenyl)boranuide SMILES: [B-](C1=CC=C(C=C1)I)(F)(F)F.[K+]
1-Iodo-4-n-pentylbenzene, 98%
CAS: 85017-60-3 Molecular Formula: C11H15I Molecular Weight (g/mol): 274.145 MDL Number: MFCD00079767 InChI Key: MTRMOYSZRPLAOL-UHFFFAOYSA-N Synonym: 4-iodopentylbenzene,1-iodo-4-n-pentylbenzene,4-pentyliodobenzene,#,1-iodanyl-4-pentyl-benzene PubChem CID: 145057 IUPAC Name: 1-iodo-4-pentylbenzene SMILES: CCCCCC1=CC=C(C=C1)I
4-Amino-3-nitrobenzoic acid, 98%, Thermo Scientific™
CAS: 1588-83-6 Molecular Formula: C7H6N2O4 Molecular Weight (g/mol): 182.14 MDL Number: MFCD00017009 InChI Key: ZZNAYFWAXZJITH-UHFFFAOYSA-N Synonym: 4-amino-3-nitrobenzoic acid,3-nitro-4-aminobenzoic acid,benzoic acid, 4-amino-3-nitro,4-carboxy-2-nitroaniline,3-nitro-4-aminobenozic acid,4-amino-3-nitro-benzoic acid,4-amino-3-nitrobenzoicacid,pubchem4982,rarechem al bo 0261,2-nitro-4-carboxyaniline PubChem CID: 74115 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N
2-(Trifluoromethyl)phenylacetylene, 97%
CAS: 704-41-6 Molecular Formula: C9H5F3 Molecular Weight (g/mol): 170.134 MDL Number: MFCD00467313 InChI Key: OOZKONVIIMFOKW-UHFFFAOYSA-N Synonym: 1-ethynyl-2-trifluoromethyl benzene,2'-trifluoromethylphenyl acetylene,2-trifluoromethyl phenylacetylene,2-ethynyl-alpha,alpha,alpha-trifluorotoluene,2-ethynyl-a,a,a-trifluorotoluene,1-ethynyl-2-trifluoromethylbenzene,2'-trifluoromethylphenylacetylene,2-ethynylbenzotrifluoride,o-ethynyl-trifluoromethylbenzene,2-trifluoromethyl phenyl ethyne,1-ethynyl-2-trifluoromethyl-benzene PubChem CID: 4100856 IUPAC Name: 1-ethynyl-2-(trifluoromethyl)benzene SMILES: C#CC1=CC=CC=C1C(F)(F)F
tert-Butyl 4'-(bromomethyl)biphenyl-2-carboxylate, 97%
CAS: 114772-40-6 Molecular Formula: C18H19BrO2 Molecular Weight (g/mol): 347.252 MDL Number: MFCD06657561 InChI Key: YHXCWNQNVMAENQ-UHFFFAOYSA-N Synonym: 2-boc-4'-bromomethyl biphenyl,tert-butyl 4'-bromomethyl biphenyl-2-carboxylate,tert-butyl 2-4-bromomethyl phenyl benzoate,tert-butyl 4'-bromomethyl-1,1'-biphenyl-2-carboxylate,unii-me3i28o0tc,tert-butyl 4'-bromomethyl-2-biphenylcarboxylate,me3i28o0tc,telmisartan impurity h,tert-butyl 2-4-bromomethylphenyl benzoate,1,1-dimethylethyl 4'-bromomethyl biphenyl-2-carboxylate PubChem CID: 9906257 IUPAC Name: tert-butyl 2-[4-(bromomethyl)phenyl]benzoate SMILES: CC(C)(C)OC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CBr
Phenylazoformic acid 2-phenylhydrazide
CAS: 538-62-5 Molecular Formula: C13H12N4O Molecular Weight (g/mol): 240.266 MDL Number: MFCD00003024 InChI Key: ZFWAHZCOKGWUIT-UHFFFAOYSA-N Synonym: 1,5-diphenylcarbazone,diazenecarboxylic acid, phenyl-, 2-phenylhydrazide,unii-5uyj4r0d5t,phenylazoformic acid 2-phenylhydrazide,sym-diphenylcarbazone,5uyj4r0d5t,chembl79409,3-hydroxy-1,5-diphenylformazan,phenyldiazenecarboxylic acid 2-phenylhydrazide,3-phenylamino-1-phenylimino urea PubChem CID: 10860 IUPAC Name: 1-anilino-3-phenyliminourea SMILES: C1=CC=C(C=C1)NNC(=O)N=NC2=CC=CC=C2