Benzene and substituted derivatives
3-Fluorophenylglyoxal hydrate, Thermo Scientific™
CAS: 121247-01-6 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.14 InChI Key: VGFHAWFFIQFSRR-UHFFFAOYSA-N Synonym: 3-fluorophenylglyoxal hydrate,2-3-fluorophenyl-2-oxoacetaldehyde hydrate,acmc-20an3a,3-fluorophenyl glyoxal,3-fluoro-a-oxobenzeneacetaldehyde,benzeneacetaldehyde,3-fluoro-a-oxo,2-3-fluorophenyl-2-oxoethanal, hydrate PubChem CID: 2783267 IUPAC Name: 2-(3-fluorophenyl)-2-oxoacetaldehyde;hydrate SMILES: O.FC1=CC=CC(=C1)C(=O)C=O
4-n-Butoxyaniline, 97%
CAS: 4344-55-2 Molecular Formula: C10H15NO Molecular Weight (g/mol): 165.236 MDL Number: MFCD00007866 InChI Key: UBRIHZOFEJHMIT-UHFFFAOYSA-N Synonym: p-butoxyaniline,benzenamine, 4-butoxy,p-butyloxyaniline,4-n-butoxyaniline,aniline, p-butoxy,p-aminophenol n-butyl ether,4-butyloxybenzenamine,aminophenyl-n-butyl ether,4-butyloxyaniline,4-butyloxy aniline PubChem CID: 20352 IUPAC Name: 4-butoxyaniline SMILES: CCCCOC1=CC=C(C=C1)N
2,4-Dichloro-6-methylaniline, 97%
CAS: 30273-00-8 Molecular Formula: C7H7Cl2N Molecular Weight (g/mol): 176.04 MDL Number: MFCD00044074 InChI Key: UAISVUGQLKXPFF-UHFFFAOYSA-N Synonym: 4,6-dichloro-2-methylaniline,benzenamine, 2,4-dichloro-6-methyl,acmc-20aodo,4,6-dichloro-o-toluidine,2-amino-3,5-dichlorotoluene,2,4-dichloro-6-methylphenylamine,4,6-dichloro-2-methylphenylamine,2,4-bis chloranyl-6-methyl-aniline,2,4-dichloro-6-methylaniline PubChem CID: 1268287 IUPAC Name: 2,4-dichloro-6-methylaniline SMILES: CC1=CC(=CC(=C1N)Cl)Cl
4-n-Propylphenylboronic acid, 95%, Thermo Scientific™
CAS: 134150-01-9 Molecular Formula: C9H13BO2 Molecular Weight (g/mol): 164.01 MDL Number: MFCD00859261 InChI Key: WLCGYIWOKVWFLB-UHFFFAOYSA-N Synonym: 4-propylphenyl boronic acid,4-propyl benzeneboronic acid,4-propylphenylboronicacid,4-n-propylphenylboronic acid,4-n-propylbenzeneboronic acid,boronic acid, 4-propylphenyl,pubchem7892,acmc-209btz,4-propylphenyboronic acid PubChem CID: 4100861 IUPAC Name: (4-propylphenyl)boronic acid SMILES: CCCC1=CC=C(C=C1)B(O)O
Phenylazoformic acid 2-phenylhydrazide compound with 1,5-Diphenylcarbohydrazide, ACS
CAS: 10329-15-4 Molecular Formula: C26H26N8O2 Molecular Weight (g/mol): 482.55 MDL Number: MFCD00013218 InChI Key: WDJPBIRJSVMEKJ-UHFFFAOYSA-N Synonym: 1-anilino-3-phenyliminourea; 1,3-dianilinourea,1,5-diphenylcarbazide; 3-phenylamino-1-phenylimino urea,n',2-diphenyldiazenecarbohydrazide compound with n,n'-diphenylcarbonohydrazide 1:1,a.c.s. reagent cpd w/1 5-diph-carbazide,diphenylcarbazone compound with diphenylcarbazide,3e-1-anilino-3-phenylimino-urea; 1,3-dianilinourea,diphenylcarbazone compound with s-diphenyl carbazide, acs,e-1-phenylamino-3-phenylimino urea; 1,5-diphenylcarbazide,e-3-phenylamino-1-phenylimino urea; 1,5-diphenylcarbazide,phenylazoformic acid 2-phenylhydrazide compound 1,5diphenylcarbohydrazide PubChem CID: 221124 IUPAC Name: 1-anilino-3-phenyliminourea;1,3-dianilinourea SMILES: O=C(NNC1=CC=CC=C1)NNC1=CC=CC=C1.O=C(NNC1=CC=CC=C1)N=NC1=CC=CC=C1
3-Ethoxybenzonitrile, 95%
CAS: 25117-75-3 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00001805 InChI Key: PFNAUBYHTWDKBO-UHFFFAOYSA-N Synonym: benzonitrile, 3-ethoxy,benzonitrile, m-ethoxy,m-ethoxy benzonitrile,acmc-20an4n,3-ethoxybenzenecarbonitrile,3-ethoxybenzoic acid nitrile PubChem CID: 91283 IUPAC Name: 3-ethoxybenzonitrile SMILES: CCOC1=CC=CC(=C1)C#N
m-Xylylene dibromide, 97%
CAS: 626-15-3 Molecular Formula: C8H8Br2 Molecular Weight (g/mol): 263.96 MDL Number: MFCD00000178 InChI Key: OXHOPZLBSSTTBU-UHFFFAOYSA-N Synonym: 1,3-bis bromomethyl benzene,m-xylylene dibromide,alpha,alpha'-dibromo-m-xylene,benzene, 1,3-bis bromomethyl,m-bis bromomethyl benzene,m-xylylene bromide,ccris 1777,m-xylyene dibromide,m-xylene, .alpha.,.alpha.'-dibromo,m-.alpha.,.alpha.'-dibromoxylene PubChem CID: 69373 IUPAC Name: 1,3-bis(bromomethyl)benzene SMILES: C1=CC(=CC(=C1)CBr)CBr
3-(Trifluoromethyl)benzyl alcohol, 97%
CAS: 349-75-7 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00004645 InChI Key: BXEHKCUWIODEDE-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzyl alcohol,3-trifluoromethylbenzyl alcohol,3-trifluoromethyl phenyl methanol,3-trifluoromethyl benzylalcohol,m-trifluoromethylbenzyl alcohol,m-trifluoromethyl benzyl alcohol,3-trifluoromethyl benzylic alcohol,benzenemethanol, 3-trifluoromethyl,m-trifluorome benzyl alcohol PubChem CID: 67681 IUPAC Name: [3-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=CC(=C1)C(F)(F)F)CO
Methyl 3-amino-4-iodobenzoate, 97%
CAS: 412947-54-7 Molecular Formula: C8H8INO2 Molecular Weight (g/mol): 277.061 MDL Number: MFCD08064225 InChI Key: WJEBNIVVLJEIKE-UHFFFAOYSA-N Synonym: 3-amino-4-iodobenzoic acid methyl ester,benzoic acid, 3-amino-4-iodo-, methyl ester,methyl3-amino-4-iodobenzoate,pubchem10509,acmc-209ygt,ksc495i4l,methyl-3-amino-4-iodobenzoate,methyl 3-amino-4-iodo-benzoate,3-amino-4-iodo-benzoic acid methyl ester PubChem CID: 21628210 IUPAC Name: methyl 3-amino-4-iodobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)I)N
3-Bromobenzotrifluoride, 98+%
CAS: 401-78-5 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.008 MDL Number: MFCD00000380 InChI Key: NNMBNYHMJRJUBC-UHFFFAOYSA-N Synonym: 3-bromobenzotrifluoride,1-bromo-3-trifluoromethyl benzene,m-bromobenzotrifluoride,3-trifluoromethyl bromobenzene,benzene, 1-bromo-3-trifluoromethyl,3-brombenzotrifluorid,3-bromotrifluoromethylbenzene,3-bromobenzyltrifluoride,3-trifluoromethyl phenyl bromide,m-trifluoromethyl bromobenzene PubChem CID: 9817 IUPAC Name: 1-bromo-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)Br)C(F)(F)F
2-Bromo-5-fluorobenzonitrile, 98+%
CAS: 57381-39-2 Molecular Formula: C7H3BrFN Molecular Weight (g/mol): 200.01 MDL Number: MFCD00142875 InChI Key: MDHNVHCZDCSTMS-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorobenzenecarbonitrile,2-bromo-5-fluoro-benzonitrile,benzonitrile, 2-bromo-5-fluoro,2-cyano-4-fluorobromobenzene,pubchem3218,bromofluorobenzonitrile2,acmc-1awgr,brc6h3 f cn,ksc496i7h,2-bromo-5-fluorobenzonitrile PubChem CID: 93654 IUPAC Name: 2-bromo-5-fluorobenzonitrile SMILES: FC1=CC=C(Br)C(=C1)C#N
4-Fluorosalicylic acid, 98%
CAS: 345-29-9 Molecular Formula: C7H5FO3 Molecular Weight (g/mol): 156.11 MDL Number: MFCD00153168 InChI Key: TTZOLDXHOCCNMF-UHFFFAOYSA-N Synonym: 4-fluorosalicylic acid,4-fluorosalicyclic acid,2-hydroxy-4-fluorobenzoic acid,4-fluoro-2-hydroxy-benzoic acid,fluorohydroxybenzoicacid5,benzoic acid, 4-fluoro-2-hydroxy,4-fluorosalicylicacid,zlchem 109,pubchem3493 PubChem CID: 67661 IUPAC Name: 4-fluoro-2-hydroxybenzoic acid SMILES: OC(=O)C1=CC=C(F)C=C1O
4'-Methoxy-2'-nitroacetanilide, 98+%
CAS: 119-81-3 Molecular Formula: C9H10N2O4 Molecular Weight (g/mol): 210.189 MDL Number: MFCD00017018 InChI Key: QGEGALJODPBPGR-UHFFFAOYSA-N Synonym: n-4-methoxy-2-nitrophenyl acetamide,4'-methoxy-2'-nitroacetanilide,4-methoxy-2-nitroacetanilide,2'-nitro-p-acetanisidide,acetamide, n-4-methoxy-2-nitrophenyl,2-nitro-p-acetanisidide,p-acetanisidide, 2-nitro,4-acetamido-3-nitroanisole,2-nitro-4-methoxyacetanilide,p-acetanisidide, 2'-nitro PubChem CID: 67075 IUPAC Name: N-(4-methoxy-2-nitrophenyl)acetamide SMILES: CC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]
![[2-(Phenoxymethyl)phenyl]methanol, 97%, Thermo Scientific™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-34904-98-8.jpg-250.jpg)
[2-(Phenoxymethyl)phenyl]methanol, 97%, Thermo Scientific™
CAS: 34904-98-8 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.264 MDL Number: MFCD08690312 InChI Key: RMRTWBZKENSMCI-UHFFFAOYSA-N Synonym: 2-phenoxymethyl phenyl methanol,benzenemethanol,2-phenoxymethyl,2-phenoxymethyl phenyl methan-1-ol PubChem CID: 22932170 IUPAC Name: [2-(phenoxymethyl)phenyl]methanol SMILES: C1=CC=C(C=C1)OCC2=CC=CC=C2CO
![N-Methyl-2-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzylamine, 97%, Thermo Scientific™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-898598-62-4.jpg-250.jpg)
N-Methyl-2-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzylamine, 97%, Thermo Scientific™
CAS: 898598-62-4 Molecular Formula: C13H14F3N3 Molecular Weight (g/mol): 269.271 MDL Number: MFCD09817515 InChI Key: OTPQTKMWNNGSEX-UHFFFAOYSA-N Synonym: n-methyl-2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzylamine,methyl 2-2-methyl-5-trifluoromethyl pyrazol-3-yl phenyl methyl amine,n-methyl-1-2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl phenyl methanamine,n-methyl-1-2-2-methyl-5-trifluoromethyl-3-pyrazolyl phenyl methanamine,n-methyl-1-2-2-methyl-5-trifluoromethyl pyrazol-3-yl phenyl methanamine,benzenemethanamine,n-methyl-2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl PubChem CID: 24229664 IUPAC Name: N-methyl-1-[2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]methanamine SMILES: CNCC1=CC=CC=C1C2=CC(=NN2C)C(F)(F)F