Benzenoids
1-Bromobenzyl methyl ether, 98%
CAS: 52711-30-5 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD03790887 InChI Key: QFAZLCRHLRJNAW-UHFFFAOYSA-N Synonym: 1-bromo-2-methoxymethyl benzene,2-bromobenzyl methyl ether,acmc-20ag76,methyl 2-bromobenzyl ether,1-methoxymethyl-2-bromobenzene,2-bromobenzyl alcohol, methyl ether,benzene,1-bromo-2-methoxymethyl PubChem CID: 12927162 IUPAC Name: 1-bromo-2-(methoxymethyl)benzene SMILES: COCC1=CC=CC=C1Br
(R)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee
CAS: 134615-24-0 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD06658929 InChI Key: ULMJQMDYAOJNCC-ZCFIWIBFSA-N Synonym: r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethan-1-ol,pubchem15565,r-1-m-bromophenyl ethanol,r-1-3-bromo-phenyl-ethanol,r-3-bromo-alpha-methylbenzyl alcohol,benzenemethanol, 3-bromo-a-methyl-, ar PubChem CID: 2734889 IUPAC Name: (1R)-1-(3-bromophenyl)ethanol SMILES: CC(C1=CC(=CC=C1)Br)O
3-Fluorophenethyl alcohol, 99%, Thermo Scientific Chemicals
CAS: 52059-53-7 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.16 MDL Number: MFCD00045998 InChI Key: MZNBGEKFZCWVES-UHFFFAOYSA-N Synonym: 2-3-fluorophenyl ethanol,3-fluorophenethyl alcohol,2-3-fluorophenyl ethan-1-ol,benzeneethanol, 3-fluoro,3-fluorophenethylalcohol,2-3-fluorophenyl ethylalcohol,3-fluorobenzenethanol,3-fluorophenylethanol,3-fluorobenzeneethanol,acmc-209kxl PubChem CID: 573132 IUPAC Name: 2-(3-fluorophenyl)ethanol SMILES: OCCC1=CC=CC(F)=C1
Chloropentafluorobenzene, 98+%
CAS: 344-07-0 Molecular Formula: C6ClF5 Molecular Weight (g/mol): 202.51 MDL Number: MFCD00000534 InChI Key: KGCDGLXSBHJAHZ-UHFFFAOYSA-N Synonym: chloropentafluorobenzene,pentafluorochlorobenzene,benzene, chloropentafluoro,pentafluorophenyl chloride,chloroperfluorobenzene,ccris 2394,pentafluorochloro benzene,1-chloro-2,3,4,5,6-pentafluoro-benzene,benzene, 1-chloro-2,3,4,5,6-pentafluoro,pentafluorophenylchloride PubChem CID: 9579 IUPAC Name: 1-chloro-2,3,4,5,6-pentafluorobenzene SMILES: FC1=C(F)C(F)=C(Cl)C(F)=C1F
Allyltriphenylphosphonium chloride, 99%
CAS: 18480-23-4 Molecular Formula: C21H20ClP Molecular Weight (g/mol): 338.81 MDL Number: MFCD00031542 InChI Key: FKMJROWWQOJRJX-UHFFFAOYSA-M Synonym: allyltriphenylphosphonium chloride,allyl triphenylphosphonium chloride,triphenyl prop-2-enyl phosphanium chloride,triphenyl prop-2-en-1-yl phosphanium chloride,acmc-1buz2,allyltriphenylphosphoniumchloride,triphenyl prop-2-enyl phosphonium chloride,phosphonium,triphenyl-2-propen-1-yl-, chloride 1:1 PubChem CID: 2734120 SMILES: [Cl-].C=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
2,6-Dimethyl-4-nitrophenol, 98%
CAS: 2423-71-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00007339 InChI Key: FNORUNUDZNWQFF-UHFFFAOYSA-N PubChem CID: 17030 IUPAC Name: 2,6-dimethyl-4-nitrophenol SMILES: CC1=CC(=CC(=C1O)C)[N+](=O)[O-]
4-Nitroguaiacol, 97%
CAS: 3251-56-7 Molecular Formula: C7H7NO4 Molecular Weight (g/mol): 169.14 MDL Number: MFCD00012143 InChI Key: IZLVFLOBTPURLP-UHFFFAOYSA-N Synonym: 4-nitroguaiacol,phenol, 2-methoxy-4-nitro,guaiacol, 4-nitro,2-hydroxy-5-nitroanisole,3-nitro-6-hydroxyanisole,4-hydroxy-3-methoxynitrobenzene,phenol, o-methoxy-p-nitro,o-methoxy-p-nitrophenol,2-methoxy-4-nitro-phenol,4-nitrogualacol PubChem CID: 76738 ChEBI: CHEBI:81050 IUPAC Name: 2-methoxy-4-nitrophenol SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])O
4-Methylsulphonylbenzyl bromide, Tech.
CAS: 53606-06-7 Molecular Formula: C8H9BrO2S Molecular Weight (g/mol): 249.13 MDL Number: MFCD00185849 InChI Key: HGKPAXHJTMHWAH-UHFFFAOYSA-N Synonym: 1-bromomethyl-4-methylsulfonyl benzene,4-methylsulfonyl benzyl bromide,1-bromomethyl-4-methanesulfonylbenzene,benzene, 1-bromomethyl-4-methylsulfonyl,4-methylsulphonylbenzyl bromide,4-methylsulfonyl benzylbromide,1-bromomethyl-4-methanesulfonyl-benzene,1-bromomethyl-4-methylsulfonylbenzene,pubchem18666,acmc-1b0ix PubChem CID: 2733581 IUPAC Name: 1-(bromomethyl)-4-methylsulfonylbenzene SMILES: CS(=O)(=O)C1=CC=C(C=C1)CBr
5-Methoxy-2-nitrophenol, 98%
CAS: 704-14-3 Molecular Formula: C7H7NO4 Molecular Weight (g/mol): 169.14 MDL Number: MFCD00100932 InChI Key: NRTULWPODYLFOJ-UHFFFAOYSA-N PubChem CID: 219635 IUPAC Name: 5-methoxy-2-nitrophenol SMILES: COC1=CC=C(C(O)=C1)[N+]([O-])=O
2-Amino-4,5-dimethoxybenzoic acid, 98%
CAS: 5653-40-7 Molecular Formula: C9H11NO4 Molecular Weight (g/mol): 197.19 MDL Number: MFCD00011671 InChI Key: HJVAVGOPTDJYOJ-UHFFFAOYSA-N Synonym: 4,5-dimethoxyanthranilic acid,6-aminoveratric acid,benzoic acid, 2-amino-4,5-dimethoxy,2-amino-4,5-dimethoxy benzoic acid,2-amino-4,5-dimethoxy-benzoic acid,6-aminoveratricacid,zlchem 238,pubchem3110,acmc-1b03r,ksc269i1n PubChem CID: 79736 IUPAC Name: 2-amino-4,5-dimethoxybenzoic acid SMILES: COC1=CC(N)=C(C=C1OC)C(O)=O
3-Methoxyphenyl isothiocyanate, 98%
CAS: 3125-64-2 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00040335 InChI Key: WHBYCPUKGYEYFU-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,# PubChem CID: 137832 IUPAC Name: 1-isothiocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=S
3,5-Dimethoxy-4-methylbenzoic acid, 97%
CAS: 61040-81-1 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00017506 InChI Key: QIBMVRYNEXOCCF-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-4-methyl-benzoic acid,benzoic acid,3,5-dimethoxy-4-methyl,3,5-dimethoxy-4-methylbenzoicacid,acmc-1b58y,3,5-dimethoxy4-methylbenzoic acid,4-methyl-3,5-dimethoxybenzoic acid,3,5-dimethoxy-p-toluic acid,labotest-bb lt00455447,3,5-dimethoxy-4-methyl benzoic acid,3,5-di-methoxy-4-methyl-benzoic acid PubChem CID: 3764486 IUPAC Name: 3,5-dimethoxy-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1OC)C(=O)O)OC
3,4-Dihydroxybenzonitrile, 97%, Thermo Scientific Chemicals
CAS: 17345-61-8 Molecular Formula: C7H5NO2 Molecular Weight (g/mol): 135.122 MDL Number: MFCD00016436 InChI Key: NUWHYWYSMAPBHK-UHFFFAOYSA-N Synonym: protocatachuonitrile,3,4-dihydroxy benzonitrile,3,4-dihydroxybenzenecarbonitrile,protocatechuonitrile,4-cyanocatechol,protocatechunitrile,4-cyanopyrocatechol,pubchem3120,acmc-209e6q,3, 4-dihydroxybenzonitrile PubChem CID: 87065 IUPAC Name: 3,4-dihydroxybenzonitrile SMILES: C1=CC(=C(C=C1C#N)O)O
4-(Trifluoromethyl)benzoic acid, 98+%
CAS: 455-24-3 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00002562 InChI Key: SWKPKONEIZGROQ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzoic acid,p-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-p-toluic acid,benzoic acid, 4-trifluoromethyl,p-carboxybenzotrifluoride,4-trifluoromethyl-benzoic acid,a,a,a-trifluoro-p-toluic acid,ptf-boa,4-carboxybenzotrifluoride PubChem CID: 9966 ChEBI: CHEBI:60696 IUPAC Name: 4-(trifluoromethyl)benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)C(F)(F)F