Benzene and substituted derivatives
4-Fluorobenzoic acid, 98%
CAS: 456-22-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002530 InChI Key: BBYDXOIZLAWGSL-UHFFFAOYSA-N Synonym: p-fluorobenzoic acid,benzoic acid, 4-fluoro,para-fluorobenzoic acid,4-fluoro-benzoic acid,benzoic acid, p-fluoro,unii-v5roo2hou4,p-fluoro-benzoic acid,v5roo2hou4,4-fluorobenzoatd,p-flurobenzoic acid PubChem CID: 9973 ChEBI: CHEBI:20364 IUPAC Name: 4-fluorobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)F
(Methoxycarbonylmethylene)triphenylphosphorane, 98%
CAS: 2605-67-6 Molecular Formula: C21H19O2P Molecular Weight (g/mol): 334.36 MDL Number: MFCD00008455 InChI Key: NTNUDYROPUKXNA-UHFFFAOYSA-N Synonym: methyl triphenylphosphoranylidene acetate,carbomethoxymethylene triphenylphosphorane,methyl 2-triphenylphosphoranylidene acetate,acetic acid, triphenylphosphoranylidene-, methyl ester,methyl triphenylphosphoranylideneacetate,triphenylphosphoranylidene acetic acid methyl ester,triphenyl carbomethoxymethylene phosphorane,methoxycarbonylmethylene triphenylphosphorane,acetic acid, 2-triphenylphosphoranylidene-, methyl ester PubChem CID: 17453 IUPAC Name: methyl 2-(triphenyl-$l^{5}-phosphanylidene)acetate SMILES: COC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
2-Acetylnaphthalene, 99%
CAS: 93-08-3 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00004108 InChI Key: XSAYZAUNJMRRIR-UHFFFAOYSA-N Synonym: 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone PubChem CID: 7122 ChEBI: CHEBI:52364 IUPAC Name: 1-naphthalen-2-ylethanone SMILES: CC(=O)C1=CC2=CC=CC=C2C=C1
2-Iodobenzotrifluoride, 99%
CAS: 444-29-1 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.009 MDL Number: MFCD00001041 InChI Key: IGZGUYVVBABKOY-UHFFFAOYSA-N Synonym: 2-iodobenzotrifluoride,1-iodo-2-trifluoromethyl benzene,o-iodobenzotrifluoride,benzene, 1-iodo-2-trifluoromethyl,2-iodobenztrifluoride,o-trifluoromethyliodobenzene,2-iodo-alpha,alpha,alpha-trifluorotoluene,iodobenzotrifluoride,2-iodo-a,a,a-trifluorotoluene,2-iodobenzotrifloride PubChem CID: 67957 IUPAC Name: 1-iodo-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)I
2-Nitro-m-xylene, 99%
CAS: 81-20-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007181 InChI Key: HDFQKJQEWGVKCQ-UHFFFAOYSA-N Synonym: 2-nitro-m-xylene,2,6-dimethylnitrobenzene,benzene, 1,3-dimethyl-2-nitro,2,6-dimethyl-1-nitrobenzene,m-xylene, 2-nitro,ccris 3119,1,3-dimethyl-2-nitro-benzene,dsstox_cid_5134,dsstox_rid_77678,dsstox_gsid_25134 PubChem CID: 6672 IUPAC Name: 1,3-dimethyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)C)[N+](=O)[O-]
o-Tolualdehyde, 98%, stab. with 0.1% hydroquinone
CAS: 529-20-4 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00003338 InChI Key: BTFQKIATRPGRBS-UHFFFAOYSA-N Synonym: o-tolualdehyde,2-tolualdehyde,2-formyltoluene,o-toluylaldehyde,o-toluic aldehyde,o-tolylaldehyde,o-methylbenzaldehyde,benzaldehyde, 2-methyl,2-methyl-benzaldehyde,o-methylbenazldehyde PubChem CID: 10722 ChEBI: CHEBI:27434 IUPAC Name: 2-methylbenzaldehyde SMILES: CC1=CC=CC=C1C=O
Methyl p-tolyl sulfone, 99%
CAS: 3185-99-7 Molecular Formula: C8H10O2S Molecular Weight (g/mol): 170.23 MDL Number: MFCD00014742 InChI Key: YYDNBUBMBZRNQQ-UHFFFAOYSA-N Synonym: methyl p-tolyl sulfone,1-methyl-4-methylsulfonyl benzene,4-methylsulfonyl toluene,benzene, 1-methyl-4-methylsulfonyl,p-tolyl methyl sulfone,sulfone, methyl p-tolyl,4-methylsulphonyl toluene,1-methanesulfonyl-4-methyl-benzene,unii-tg77sm513a,p-methylsulfonyltoluene PubChem CID: 18521 IUPAC Name: 1-methyl-4-methylsulfonylbenzene SMILES: CC1=CC=C(C=C1)S(C)(=O)=O
p-Xylylene dichloride, 98%
CAS: 623-25-6 Molecular Formula: C8H8Cl2 Molecular Weight (g/mol): 175.052 MDL Number: MFCD00000920 InChI Key: ZZHIDJWUJRKHGX-UHFFFAOYSA-N Synonym: 1,4-bis chloromethyl benzene,alpha,alpha'-dichloro-p-xylene,p-xylylene dichloride,p-xylylene chloride,benzene, 1,4-bis chloromethyl,p-bis chloromethyl benzene,benzene, p-bis chloromethyl,a,a'-dichloro-p-xylene,xylylene dichloride,ccris 1772 PubChem CID: 12171 IUPAC Name: 1,4-bis(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)CCl
3,5-Dimethoxybenzoic acid, 99%
CAS: 1132-21-4 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002502 InChI Key: IWPZKOJSYQZABD-UHFFFAOYSA-N Synonym: benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy PubChem CID: 14332 IUPAC Name: 3,5-dimethoxybenzoic acid SMILES: COC1=CC(=CC(OC)=C1)C(O)=O
5-Fluoro-2-nitrotoluene, 98+%
CAS: 446-33-3 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007283 InChI Key: JHFOWEGCZWLHNW-UHFFFAOYSA-N Synonym: 5-fluoro-2-nitrotoluene,3-fluoro-6-nitrotoluene,4-fluoro-2-methylnitrobenzene,2-nitro-5-fluoro toluene,benzene, 4-fluoro-2-methyl-1-nitro,toluene, 5-fluoro-2-nitro,2-nitro-5-fluorotoluene,2-methyl-4-fluoronitrobenzene,3-methyl-4-nitrofluorobenzene,4-fluoro-2-methyl-1-nitro-benzene PubChem CID: 94956 IUPAC Name: 4-fluoro-2-methyl-1-nitrobenzene SMILES: CC1=C(C=CC(=C1)F)[N+](=O)[O-]
2-(4-Chloro-3-nitrobenzoyl)benzoic acid, 98%
CAS: 85-54-1 Molecular Formula: C14H8ClNO5 Molecular Weight (g/mol): 305.67 MDL Number: MFCD00007082 InChI Key: RITAQDHCJBLSSL-UHFFFAOYSA-N Synonym: 2-4-chloro-3-nitrobenzoyl benzoic acid,benzoic acid, 2-4-chloro-3-nitrobenzoyl,3'-nitro-4'-chlorobenzoylbenzoic acid,benzoic acid, o-4-chloro-3-nitrobenzoyl,2-4-chloro-3-nitrophenyl carbonyl benzoic acid,acmc-209q6m,ksc496o4t,o-4-chloro-3-nitrobenzoyl benzoic acid,2-4-chloro-3-nitro-benzoyl benzoic acid,2-4'-chloro-3'-nitrobenzoyl benzoic acid PubChem CID: 66562 IUPAC Name: 2-(4-chloro-3-nitrobenzoyl)benzoic acid SMILES: OC(=O)C1=CC=CC=C1C(=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O
Methyl benzoylformate, 99%
CAS: 15206-55-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00008443 InChI Key: YLHXLHGIAMFFBU-UHFFFAOYSA-N Synonym: methyl benzoylformate,methyl phenylglyoxylate,methyl oxophenylacetate,methyl phenylglyoxalate,benzoylformic acid methyl ester,methylbenzoylformate,phenylglyoxylic acid methyl ester,phenylglyoxylic acid, methyl ester,benzeneacetic acid, .alpha.-oxo-, methyl ester,unii-23f2045stg PubChem CID: 84835 ChEBI: CHEBI:84256 IUPAC Name: methyl 2-oxo-2-phenylacetate SMILES: COC(=O)C(=O)C1=CC=CC=C1
Phenyl sulfone, 97%
CAS: 127-63-9 Molecular Formula: C12H10O2S Molecular Weight (g/mol): 218.27 MDL Number: MFCD00007548 InChI Key: KZTYYGOKRVBIMI-UHFFFAOYSA-N Synonym: diphenyl sulfone,phenyl sulfone,sulfonyldibenzene,diphenylsulfone,sulfobenzide,diphenyl sulphone,benzene, 1,1'-sulfonylbis,sulfone, diphenyl,1,1'-sulfonyldibenzene,phenyl sulphone PubChem CID: 31386 ChEBI: CHEBI:78360 SMILES: O=S(=O)(C1=CC=CC=C1)C1=CC=CC=C1
4'-Methylacetanilide, 98+%
CAS: 103-89-9 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 MDL Number: MFCD00008677 InChI Key: YICAMJWHIUMFDI-UHFFFAOYSA-N Synonym: 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide PubChem CID: 7684 IUPAC Name: N-(4-methylphenyl)acetamide SMILES: CC1=CC=C(C=C1)NC(=O)C
1-Bromo-2,4-dimethoxybenzene, 98%
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