Benzene and substituted derivatives
3-Bromobenzeneboronic acid, 98+%
CAS: 89598-96-9 Molecular Formula: C6H6BBrO2 Molecular Weight (g/mol): 200.83 MDL Number: MFCD00239386 InChI Key: AFSSVCNPDKKSRR-UHFFFAOYSA-N Synonym: 3-bromophenyl boronic acid,3-bromobenzeneboronic acid,3-bromophenylboronicacid,boronic acid, 3-bromophenyl,pubchem1758,3-bromo-phenylboronic acid,acmc-209r1w,3-bromo-benzeneboronic acid,3-bromobenzene boronic acid PubChem CID: 2734318 IUPAC Name: (3-bromophenyl)boronic acid SMILES: OB(O)C1=CC=CC(Br)=C1
3-Iodobenzaldehyde, 98%
CAS: 696-41-3 Molecular Formula: C7H5IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039573 InChI Key: RZODAQZAFOBFLS-UHFFFAOYSA-N Synonym: 3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde PubChem CID: 252610 IUPAC Name: 3-iodobenzaldehyde SMILES: C1=CC(=CC(=C1)I)C=O
5-Isopropyl-2-methoxybenzeneboronic acid, 98+%
CAS: 216393-63-4 Molecular Formula: C10H15BO3 Molecular Weight (g/mol): 194.037 MDL Number: MFCD01318154 InChI Key: UTKAEAGLVJFBMK-UHFFFAOYSA-N Synonym: 5-isopropyl-2-methoxyphenylboronic acid,5-isopropyl-2-methoxyphenyl boronic acid,5-isopropyl-2-methoxybenzeneboronic acid,boronic acid, 2-methoxy-5-1-methylethyl phenyl,2-methoxy-5-propan-2-ylphenyl boronic acid,2-methoxy-5-1-methylethyl phenyl boronic acid,2-methoxy-5-propan-2-yl phenyl boronic acid,acmc-1cp8q,2-methoxy-5-propan-2-yl-phenyl boronic acid,5-isopropyl-2-methoxyphenyl boronicacid PubChem CID: 4589190 IUPAC Name: (2-methoxy-5-propan-2-ylphenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)C(C)C)OC)(O)O
Tris(pentafluorophenyl)borane, 97%
CAS: 1109-15-5 Molecular Formula: C18BF15 Molecular Weight (g/mol): 511.98 MDL Number: MFCD00269813 InChI Key: OBAJXDYVZBHCGT-UHFFFAOYSA-N Synonym: tris pentafluorophenyl borane,tris perfluorophenyl borane,tris pentafluorophenyl boron,tris 2,3,4,5,6-pentafluorophenyl borane,unii-i3wu5e2578,tris pentafluorophenyl-borane,borane, tris pentafluorophenyl,borane, tris 2,3,4,5,6-pentafluorophenyl,perfluorotriphenylboron,zlchem 1272 PubChem CID: 582056 IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)borane SMILES: FC1=C(F)C(F)=C(B(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F
3-(4-Methoxybenzoyl)acrylic acid, 98%
CAS: 5711-41-1 Molecular Formula: C11H10O4 Molecular Weight (g/mol): 206.20 MDL Number: MFCD00020486 InChI Key: WORYXBDHTBWLLL-VOTSOKGWSA-N Synonym: 3-4-methoxybenzoyl acrylic acid,4-4-methoxyphenyl-4-oxobut-2-enoic acid,2e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,3-p-methoxybenzoyl acrylic acid,acrylic acid, 3-p-methoxybenzoyl,trans-3-4-methoxybenzoyl acrylic acid,e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,gamma-oxo-4-methoxybenzenecrotonic acid,4-4-methoxyphenyl-4-oxo-buten-2-saeure,4-4-methoxyphenyl-4-oxo-2-butenoic acid PubChem CID: 5355095 IUPAC Name: (E)-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid SMILES: COC1=CC=C(C=C1)C(=O)\C=C\C(O)=O
2,4,6-Trifluorobenzotrifluoride, 96%
CAS: 122030-04-0 Molecular Formula: C7H2F6 Molecular Weight (g/mol): 200.083 MDL Number: MFCD00190109 InChI Key: SGPXFVDJRSZIPK-UHFFFAOYSA-N Synonym: 2,4,6-trifluorobenzotrifluoride,1,3,5-trifluoro-2-trifluoromethyl benzene,pubchem4877,2,4,6-trifluorobenzotrifluorode,2,4,6-tri-fluorobenzotrifluoride,benzene, 1,3,5-trifluoro-2-trifluoromethyl,alpha,alpha,alpha,2,4,6-hexafluorotoluene,alpha,alpha,alpha,2,4,6-hexafluorotoluene;1,3,5-trifluoro-2-trifluoromethyl benzene PubChem CID: 2734030 IUPAC Name: 1,3,5-trifluoro-2-(trifluoromethyl)benzene SMILES: C1=C(C=C(C(=C1F)C(F)(F)F)F)F
2-Chloro-6-methylbenzoic acid, 97%
CAS: 21327-86-6 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00045799 InChI Key: CEFMMQYDPGCYMG-UHFFFAOYSA-N Synonym: 6-chloro-o-toluic acid,2-chloro-6-methyl-benzoic acid,o-toluic acid, 6-chloro,2-chloro-6-methylbenzoicacid,benzoic acid, 2-chloro-6-methyl,benzoic acid, 6-chloro-4-methyl,6-chloro-2-methylbenzoic acid,pubchem4568,chloro-6-methylbenzoic acid,2-m-tolyloxymethyl oxirane PubChem CID: 88870 IUPAC Name: 2-chloro-6-methylbenzoic acid SMILES: CC1=C(C(=CC=C1)Cl)C(=O)O
3,4,5-Trifluorobenzeneboronic acid, 97%
CAS: 143418-49-9 Molecular Formula: C6H4BF3O2 Molecular Weight (g/mol): 175.901 MDL Number: MFCD02093069 InChI Key: UHDDEIOYXFXNNJ-UHFFFAOYSA-N Synonym: 3,4,5-trifluorophenyl boronic acid,3,4,5-trifluorobenzeneboronic acid,3,4,5-trifluorophenyl boranediol,boronic acid, b-3,4,5-trifluorophenyl,3,4,5-trifluoro phenylboric acid,boronic acid, 3,4,5-trifluorophenyl,3,4,5-trifluorophenylboronicacid,pubchem2340,acmc-209cqj PubChem CID: 2734671 IUPAC Name: (3,4,5-trifluorophenyl)boronic acid SMILES: B(C1=CC(=C(C(=C1)F)F)F)(O)O
2-Fluoro-5-nitrobenzaldehyde, 98%
CAS: 27996-87-8 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.111 MDL Number: MFCD00042298 InChI Key: VVXFDFQEIRGULC-UHFFFAOYSA-N Synonym: fluoro nitrobenzaldehyde,5-nitro-2-fluorobenzaldehyde,4-fluoro-3-formylnitrobenzene,2-fluoro-5-nitro-benzaldehyde,benzaldehyde, 2-fluoro-5-nitro,pubchem1459,acmc-209h0h,akos bb460,asischem d51510,2-fluoro-5 nitrobenzaldehyde PubChem CID: 2734770 IUPAC Name: 2-fluoro-5-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C=O)F
4-Bromophenyl isothiocyanate, 97%
CAS: 1985-12-2 Molecular Formula: C7H4BrNS Molecular Weight (g/mol): 214.08 MDL Number: MFCD00004808 InChI Key: XQACWEBGSZBLRG-UHFFFAOYSA-N Synonym: 4-bromophenyl isothiocyanate,trichofytocid,p-bromophenyl isothiocyanate,4-bromophenylisothiocyanate,benzene, 1-bromo-4-isothiocyanato,bromobenzene-4-isothiocyanate,isothiocyanic acid, p-bromophenyl ester,acmc-1bqku,wln: scnr de,p-bromophenylisothiocyanate PubChem CID: 16133 IUPAC Name: 1-bromo-4-isothiocyanatobenzene SMILES: C1=CC(=CC=C1N=C=S)Br
2,4,6-Trichlorobenzoyl chloride, 98%
CAS: 4136-95-2 Molecular Formula: C7H2Cl4O Molecular Weight (g/mol): 243.89 MDL Number: MFCD00075323 InChI Key: OZGSEIVTQLXWRO-UHFFFAOYSA-N Synonym: 2,4,6-trichlorobenzoylchloride,benzoyl chloride, 2,4,6-trichloro,mi,acmc-209jk3,ksc494s2p,2,4,6-cl3c6h2cocl,2,4,6-ttrichlorobenzoyl chloride,2,4,6-trichloro benzoyl chloride,2,4,6-trichlorobenzoic acid chloride,2,4,6-tris chloranyl benzoyl chloride PubChem CID: 2733703 IUPAC Name: 2,4,6-trichlorobenzoyl chloride SMILES: ClC(=O)C1=C(Cl)C=C(Cl)C=C1Cl
2,6-Difluorophenyl isocyanate, 97%
CAS: 65295-69-4 Molecular Formula: C7H3F2NO Molecular Weight (g/mol): 155.104 MDL Number: MFCD00001998 InChI Key: YXHDLKWTPVMIOH-UHFFFAOYSA-N Synonym: 2,6-difluorophenyl isocyanate,2,6-difluorophenylisocyanate,benzene, 1,3-difluoro-2-isocyanato,2,6-difluorobenzenisocyanate,timtec-bb sbb006664,pubchem5023,acmc-1bcwu,2,6 difluorophenylisocyanate,2,6-difluoro phenyl isocyanate,1-isocyanato-2,6-difluoro benzene PubChem CID: 522162 IUPAC Name: 1,3-difluoro-2-isocyanatobenzene SMILES: C1=CC(=C(C(=C1)F)N=C=O)F
3,5-Dimethylphenylacetonitrile, 98%
CAS: 39101-54-7 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.205 MDL Number: MFCD00060304 InChI Key: LMUKNQSVBFEUKR-UHFFFAOYSA-N Synonym: 3,5-dimethylphenylacetonitrile,2-3,5-dimethylphenyl acetonitrile,3,5-dimethylphenyl acetonitrile,benzeneacetonitrile, 3,5-dimethyl,3,5-dimethyl-phenyl-acetonitrile,2-3,5-dimethylphenyl ethanenitrile,acmc-20a3vm,3.5-dimethylphenylacetonitril,3,5-dimethylbenzeneacetonitrile,3,5-dimethylphenylethanenitrile PubChem CID: 123481 IUPAC Name: 2-(3,5-dimethylphenyl)acetonitrile SMILES: CC1=CC(=CC(=C1)CC#N)C
Ethyl pentafluorobenzoate, 98%
CAS: 4522-93-4 Molecular Formula: C9H5F5O2 Molecular Weight (g/mol): 240.13 MDL Number: MFCD00039211 InChI Key: DFUDMSIRGGTHGI-UHFFFAOYSA-N Synonym: ethyl pentafluorobenzoate,ethyl perfluorobenzoate,pentafluorobenzoic acid ethyl ester,2,3,4,5,6-pentafluoro-benzoic acid ethyl ester,benzoic acid, pentafluoro-, ethyl ester,ethylpentafluorobenzoate,acmc-1ajj1,rarechem al bi 0017,perfluorobenzoic acid ethyl ester PubChem CID: 78283 IUPAC Name: ethyl 2,3,4,5,6-pentafluorobenzoate SMILES: CCOC(=O)C1=C(F)C(F)=C(F)C(F)=C1F
4-Ethylphenylacetonitrile, 97%
CAS: 51632-28-1 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.21 MDL Number: MFCD00040893 InChI Key: NCPKDFDQDZMXCO-UHFFFAOYSA-N Synonym: 4-ethylphenylacetonitrile,2-4-ethylphenyl acetonitrile,4-ethylphenyl acetonitrile,benzeneacetonitrile, 4-ethyl,2-4-ethylphenyl ethanenitrile,4-ethylbenzylcyanide,p-ethylphenylacetonitrile,acmc-1ao1h PubChem CID: 142867 IUPAC Name: 2-(4-ethylphenyl)acetonitrile SMILES: CCC1=CC=C(CC#N)C=C1