Benzene and substituted derivatives
N-Methylhippuric acid, 99%, Thermo Scientific™
CAS: 2568-34-5 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00144940 InChI Key: PKCSYDDSNIJRIX-UHFFFAOYSA-N Synonym: benzoylsarcosine,n-methylhippuric acid,n-benzoyl-n-methylglycine,n-benzoylsarcosine,glycine, n-benzoyl-n-methyl,2-n-methylbenzamido acetic acid,sarcosine, n-benzoyl,2-benzoyl methyl amino acetic acid,chembl66391,2-n-methyl-1-phenylformamido acetic acid PubChem CID: 75728 IUPAC Name: 2-[benzoyl(methyl)amino]acetic acid SMILES: CN(CC(O)=O)C(=O)C1=CC=CC=C1
2-Methoxybenzonitrile, 99%
CAS: 6609-56-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001783 InChI Key: FSTPMFASNVISBU-UHFFFAOYSA-N Synonym: 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile PubChem CID: 81086 IUPAC Name: 2-methoxybenzonitrile SMILES: COC1=CC=CC=C1C#N
4-Chloroanisole, 99%
CAS: 623-12-1 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.582 MDL Number: MFCD00000616 InChI Key: YRGAYAGBVIXNAQ-UHFFFAOYSA-N Synonym: 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q PubChem CID: 12167 IUPAC Name: 1-chloro-4-methoxybenzene SMILES: COC1=CC=C(C=C1)Cl
2-Bromoanisole, 97%
CAS: 578-57-4 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00000064 InChI Key: HTDQSWDEWGSAMN-UHFFFAOYSA-N Synonym: 2-bromoanisole,o-bromoanisole,benzene, 1-bromo-2-methoxy,2-methoxybromobenzene,o-anisyl bromide,anisole, o-bromo,o-methoxybromobenzene,2-bromoanisol,o-methoxyphenyl bromide,2-methoxyphenyl bromide PubChem CID: 11358 IUPAC Name: 1-bromo-2-methoxybenzene SMILES: COC1=CC=CC=C1Br
2,3,5,6-Tetrafluoroanisole, 97%
CAS: 2324-98-3 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00000311 InChI Key: AXCOCGJDERQVDK-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole PubChem CID: 75351 IUPAC Name: 1,2,4,5-tetrafluoro-3-methoxybenzene SMILES: COC1=C(F)C(F)=CC(F)=C1F
Anisonitrile, 99%
CAS: 874-90-8 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001818 InChI Key: XDJAAZYHCCRJOK-UHFFFAOYSA-N Synonym: anisonitrile,p-anisonitrile,4-cyanoanisole,benzonitrile, 4-methoxy,p-methoxybenzonitrile,4-anisonitrile,p-anisylnitrile,p-cyanoanisole,p-methoxyphenyl cyanide,4-methoxy benzonitrile PubChem CID: 70129 IUPAC Name: 4-methoxybenzonitrile SMILES: COC1=CC=C(C=C1)C#N
4-Methoxy-alpha-toluenethiol, 95%, Thermo Scientific Chemicals
CAS: 6258-60-2 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.23 MDL Number: MFCD00004871 InChI Key: PTDVPWWJRCOIIO-UHFFFAOYSA-N Synonym: 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan PubChem CID: 80407 IUPAC Name: (4-methoxyphenyl)methanethiol SMILES: COC1=CC=C(CS)C=C1
2-Methoxybenzonitrile, 98%
CAS: 6609-56-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001783 InChI Key: FSTPMFASNVISBU-UHFFFAOYSA-N Synonym: 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile PubChem CID: 81086 IUPAC Name: 2-methoxybenzonitrile SMILES: COC1=CC=CC=C1C#N
1,2,3-Trimethoxybenzene, 98%
CAS: 634-36-6 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00008358 InChI Key: CRUILBNAQILVHZ-UHFFFAOYSA-N Synonym: methylsyringol,pyrogallol trimethyl ether,trimethoxybenzene,benzene, 1,2,3-trimethoxy,tri-o-methylpyrogallol,benzene, trimethoxy,unii-mre1o894fg,1,2,3-trimethoxy benzene,mre1o894fg,3,4,5-trimethoxybenzene PubChem CID: 12462 ChEBI: CHEBI:86529 IUPAC Name: 1,2,3-trimethoxybenzene SMILES: COC1=C(C(=CC=C1)OC)OC
3,5-Difluoroanisole, 97%, Thermo Scientific Chemicals
CAS: 93343-10-3 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.12 MDL Number: MFCD00042560 InChI Key: OTGQPYSISUUHAF-UHFFFAOYSA-N Synonym: 3,5-difluoroanisole,3,5-difluoro-1-methoxybenzene,benzene, 1,3-difluoro-5-methoxy,1,3-difluoro-5-methoxy-benzene,3,5-difluoro anisole,3,5-difluoroanisol,3.5-difluoroanisole,pubchem1967,3,5-difluoroanisole;,3,5,-difluoroanisole; PubChem CID: 2724518 IUPAC Name: 1,3-difluoro-5-methoxybenzene SMILES: COC1=CC(F)=CC(F)=C1
4-Ethyl-2-methoxyphenol, 98%
CAS: 2785-89-9 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00038714 InChI Key: CHWNEIVBYREQRF-UHFFFAOYSA-N Synonym: 4-ethylguaiacol,p-ethylguaiacol,2-methoxy-4-ethylphenol,phenol, 4-ethyl-2-methoxy,homocresol,guaiacyl ethane,4-ethyl-2-methoxy-phenol,4-hydroxy-3-methoxy ethylbenzene,unii-c9nfd83bj5,guaiacol, 4-ethyl PubChem CID: 62465 IUPAC Name: 4-ethyl-2-methoxyphenol SMILES: CCC1=CC=C(O)C(OC)=C1
4-Bromo-2-methylanisole, 98+%
CAS: 14804-31-0 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD01321139 InChI Key: UDLRGQOHGYWLCS-UHFFFAOYSA-N Synonym: 4-bromo-2-methylanisole,5-bromo-2-methoxytoluene,benzene, 4-bromo-1-methoxy-2-methyl,4-bromo-1-methoxy-2-methyl-benzene,2-methyl-4-bromoanisole,4-bromo2-methylanisole,acmc-1cfej,4-bromo2-methyl-anisole,4-bromo-2-methyl anisole,4-bromo-2-methyl-anisole PubChem CID: 608315 IUPAC Name: 4-bromo-1-methoxy-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)OC
Anisole, 99%, Extra Dry, AcroSeal™
CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 InChI Key: RDOXTESZEPMUJZ-UHFFFAOYSA-N Synonym: methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene PubChem CID: 7519 ChEBI: CHEBI:16579 IUPAC Name: anisole SMILES: COC1=CC=CC=C1
4-Allylanisole, 98%
CAS: 140-67-0 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00008653 InChI Key: ZFMSMUAANRJZFM-UHFFFAOYSA-N Synonym: estragole,4-allylanisole,p-allylanisole,tarragon,methyl chavicol,1-allyl-4-methoxybenzene,estragol,esdragol,esdragole,esdragon PubChem CID: 8815 ChEBI: CHEBI:4867 IUPAC Name: 1-methoxy-4-prop-2-enylbenzene SMILES: COC1=CC=C(C=C1)CC=C
4-Methoxybenzonitrile, 99%
CAS: 874-90-8 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001818 InChI Key: XDJAAZYHCCRJOK-UHFFFAOYSA-N Synonym: anisonitrile,p-anisonitrile,4-cyanoanisole,benzonitrile, 4-methoxy,p-methoxybenzonitrile,4-anisonitrile,p-anisylnitrile,p-cyanoanisole,p-methoxyphenyl cyanide,4-methoxy benzonitrile PubChem CID: 70129 IUPAC Name: 4-methoxybenzonitrile SMILES: COC1=CC=C(C=C1)C#N