Benzenoids
Bis(3,5,6-trichloro-2-n-pentyloxycarbonylphenyl) oxalate, 95%
CAS: 75203-51-9 Molecular Formula: C26H24Cl6O8 Molecular Weight (g/mol): 677.17 MDL Number: MFCD00012038 InChI Key: PURKHUDOTFUVNG-UHFFFAOYSA-N Synonym: cppo,bis 2-carbopentyloxy-3,5,6-trichlorophenyl oxalate,bis 2,3,5-trichloro-6-pentyloxy carbonyl phenyl oxalate,bis 2-carbopentyloxy-3,5,6-trichloro-phenyl oxal,ethanedioic acid, bis 2,3,5-trichloro-6-pentyloxy carbonyl phenyl ester,pentyl 3,4,6-trichloro-2-2-oxo-2-2,3,5-trichloro-6-pentyloxy carbonyl phenoxy acetyl oxy benzoate,bis 2,3,5-trichloro-6-pentoxycarbonylphenyl oxalate,bis 2,3,5-trichloro-6-pentoxycarbonyl-phenyl oxalate PubChem CID: 3018575 IUPAC Name: bis(2,3,5-trichloro-6-pentoxycarbonylphenyl) oxalate SMILES: CCCCCOC(=O)C1=C(C(=C(C=C1Cl)Cl)Cl)OC(=O)C(=O)OC2=C(C(=CC(=C2Cl)Cl)Cl)C(=O)OCCCCC
Dichlorobis(tri-o-tolylphosphine)palladium(II), 95%
CAS: 40691-33-6 Molecular Formula: C42H42Cl2P2Pd Molecular Weight (g/mol): 786.06 MDL Number: MFCD00274659 InChI Key: GMLMZLGOMMIIMA-UHFFFAOYSA-L Synonym: palladium,dichlorobis tris 2-methylphenyl phosphine PubChem CID: 90656943 IUPAC Name: palladium;tris(2-methylphenyl)phosphane;dichloride SMILES: Cl[Pd++]Cl.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1
2-Iodobenzoic acid, 98+%
CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.019 MDL Number: MFCD00002419 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I
1,2,4-Trifluorobenzene, 98+%
CAS: 367-23-7 Molecular Formula: C6H3F3 Molecular Weight (g/mol): 132.09 MDL Number: MFCD00000305 InChI Key: PEBWOGPSYUIOBP-UHFFFAOYSA-N Synonym: benzene, 1,2,4-trifluoro,unii-qww4hnq0l1,1,3,4-trifluorobenzene,qww4hnq0l1,pubchem1068,1,4-trifluorobenzene,benzene,2,4-trifluoro,1,2,4-trifluoro-benzene,1,2,4-trifluorobenzene,acmc-209io5 PubChem CID: 67773 IUPAC Name: 1,2,4-trifluorobenzene SMILES: FC1=CC=C(F)C(F)=C1
trans-N-Fmoc-4-hydroxy-L-proline, 97%
CAS: 88050-17-3 Molecular Formula: C20H19NO5 Molecular Weight (g/mol): 353.374 MDL Number: MFCD00151929 InChI Key: GOUUPUICWUFXPM-XIKOKIGWSA-N Synonym: fmoc-hyp-oh,fmoc-l-hydroxyproline,fmoc-l-4-hydroxyproline,fmoc-trans-4-hydroxy-l-proline,n-fmoc-trans-4-hydroxy-l-proline,fmoc-l-hyp-oh,trans-n-fmoc-4-hydroxy-l-proline,2s,4r-1-9h-fluoren-9-yl methoxy carbonyl-4-hydroxypyrrolidine-2-carboxylic acid,2s,4r-1-9h-fluoren-9-ylmethoxy carbonyl-4-hydroxypyrrolidine-2-carboxylic acid,n-alpha-9-fluorenylmethyloxycarbonyl-trans-l-hydroxyproline PubChem CID: 2756109 IUPAC Name: (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid SMILES: C1C(CN(C1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O
Benzyloxyacetaldehyde diethyl acetal, 98%
CAS: 42783-78-8 Molecular Formula: C13H20O3 Molecular Weight (g/mol): 224.3 MDL Number: MFCD00051786 InChI Key: VTYTZCJKJNWMGA-UHFFFAOYSA-N Synonym: 2,2-diethoxyethoxy methyl benzene,benzyloxyacetaldehyde diethyl acetal,benzene, 2,2-diethoxyethoxy methyl,acmc-20alp5,1,1-diethoxy-2-benzyloxy ethane,2,2-diethoxy-ethoxymethyl-benzene,2,2-diethoxy-1-phenylmethoxy ethane,2-benzyloxy acetaldehyde diethyl acetal PubChem CID: 4321487 IUPAC Name: 2,2-diethoxyethoxymethylbenzene SMILES: CCOC(COCC1=CC=CC=C1)OCC
Trimethyl orthobenzoate, 98%
CAS: 707-07-3 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00008474 InChI Key: IECKAVQTURBPON-UHFFFAOYSA-N Synonym: trimethyl orthobenzoate,trimethoxymethyl benzene,methyl orthobenzoate,benzene, trimethoxymethyl,trimethylorthobenzoate,orthobenzoic acid, trimethyl ester,orthobenzoic acid trimethyl ester,alpha,alpha,alpha-trimethoxytoluene,trimethoxyphenylmethane,trimethyl orthobeznoate PubChem CID: 69720 IUPAC Name: trimethoxymethylbenzene SMILES: COC(C1=CC=CC=C1)(OC)OC
2-Nitrobenzoic acid, 95%
CAS: 552-16-9 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007137 InChI Key: SLAMLWHELXOEJZ-UHFFFAOYSA-N Synonym: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
2-Amino-3,5-dibromobenzaldehyde, 97%
CAS: 50910-55-9 Molecular Formula: C7H5Br2NO Molecular Weight (g/mol): 278.931 MDL Number: MFCD00671100 InChI Key: RCPAZWISSAVDEA-UHFFFAOYSA-N Synonym: 2-amino-3,5-dibromo-benzaldehyde,3,5-dibromoanthranilaldehyde,3,5-dibromo-2-aminobenzaldehyde,benzaldehyde, 2-amino-3,5-dibromo,pubchem8245,acmc-209kqx,bromhexine impurity b,ksc272a2l,2-azanyl-3,5-bis bromanyl benzaldehyde,2-amino-3,5-dibromobenzaldehyde PubChem CID: 688305 IUPAC Name: 2-amino-3,5-dibromobenzaldehyde SMILES: C1=C(C=C(C(=C1Br)N)C=O)Br
S,S-Dimethyl-N-(p-toluenesulfonyl)sulfoximine, 98%
CAS: 22236-45-9 Molecular Formula: C9H13NO3S2 Molecular Weight (g/mol): 247.327 MDL Number: MFCD00013922 InChI Key: IRNAWARRPQUZDU-UHFFFAOYSA-N Synonym: s,s-dimethyl-n-p-toluenesulfonyl sulfoximine,s,s-dimethyl-n-p-tolylsulfonyl sulfoximine,dimethyl 4-methylbenzenesulfonyl imino-??-sulfanone,maybridge1_004531,s,s-dimethyl-n-p-tolylsulphonyl sulphoximide,dimethyl n-p-toluenesulfonyl sulfoximine,dimethyl-n-4-toluenesulfonyl sulfoximine,n-para-toluenesulfonyl dimethylsulfoximine,s.s-dimethyl-n-p-toluenesulfonyl sulfoximine,s,s-dimethyl-n-4-methylphenylsulfonyl sulfoximide PubChem CID: 99226 IUPAC Name: N-[dimethyl(oxo)-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N=S(=O)(C)C
(S)-(-)-2-Methyl-CBS-oxazaborolidine, 1M solution in toluene, Thermo Scientific Chemicals
CAS: 112022-81-8 Molecular Formula: C18H20BNO Molecular Weight (g/mol): 277.17 MDL Number: MFCD00078439 InChI Key: VMKAFJQFKBASMU-KRWDZBQOSA-N Synonym: s-2-methyl-cbs-oxazaborolidine,s-methyl oxazaborolidine,s---2-methyl-cbs-oxazaborolidine,s-5,5-diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine,corey catalyst,s-methyl-cbs-oxazaborolidine,s-3,3-diphenyl-1-methylpyrrolidino 1,2-c-1,3,2-oxazaborole,s-me-cbs catalyst,s-methyl-cbs,s-me-cbs PubChem CID: 2734713 IUPAC Name: (3aS)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole SMILES: [H][C@@]12CCCN1B(C)OC2(C1=CC=CC=C1)C1=CC=CC=C1
Ethyl salicylate, 99%
CAS: 118-61-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002215 InChI Key: GYCKQBWUSACYIF-UHFFFAOYSA-N Synonym: ethyl salicylate,sal ethyl,mesotol,salotan,salicylic ether,salicylic acid, ethyl ester,benzoic acid, 2-hydroxy-, ethyl ester,ethyl o-hydroxybenzoate,o-ethoxycarbonyl phenol,2-hydroxybenzoic acid ethyl ester PubChem CID: 8365 IUPAC Name: ethyl 2-hydroxybenzoate SMILES: CCOC(=O)C1=CC=CC=C1O
4-Bromobenzaldehyde, 99%
CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br
4-Fluorophenylboronic acid, 97%
CAS: 1765-93-1 Molecular Formula: C6H6BFO2 Molecular Weight (g/mol): 139.92 MDL Number: MFCD00039136 InChI Key: LBUNNMJLXWQQBY-UHFFFAOYSA-N Synonym: 4-fluorobenzeneboronic acid,4-fluorophenyl boronic acid,4-fluorophenyl boranediol,p-fluorophenylboronic acid,4-fluorophenylbornic acid,4-fluorophenyl dihydroxyboron,4-fluorophenyl dihydroxyborane,p-fluorophenyl boric acid,4-fluorophenyl boric acid PubChem CID: 285645 ChEBI: CHEBI:48661 IUPAC Name: (4-fluorophenyl)boronic acid SMILES: OB(O)C1=CC=C(F)C=C1
Methyl 3-nitrobenzoate, 98%
CAS: 618-95-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007250 InChI Key: AXLYJLKKPUICKV-UHFFFAOYSA-N Synonym: 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate PubChem CID: 69260 IUPAC Name: methyl 3-nitrobenzoate SMILES: COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]