Benzene and substituted derivatives
1-(4-Methoxyphenyl)-1-cyclopropanecarbonitrile, 96%
CAS: 16728-00-0 Molecular Formula: C11H11NO Molecular Weight (g/mol): 173.22 MDL Number: MFCD00019212 InChI Key: OIQRGAQXQLASRC-UHFFFAOYSA-N Synonym: 1-4-methoxyphenyl cyclopropanecarbonitrile,1-4-methoxyphenyl cyclopropane-1-carbonitrile,cyclopropanecarbonitrile, 1-4-methoxyphenyl,1-4-methoxyphenyl-1-cyclopropanecarbonitrile,1-4-methoxy-phenyl cyclopropanecarbonitrile,4-1-cyanocyclopropyl anisole,1-4-methoxy-phenyl-cyclopropanecarbonitrile,cyclopropanecarbonitrile,1-4-methoxyphenyl,1-4-methoxyphenyl-cyclopropane-1-carbonitrile,1-4-methoxyphenyl cyclopropane carbonitrile PubChem CID: 85574 IUPAC Name: 1-(4-methoxyphenyl)cyclopropane-1-carbonitrile SMILES: COC1=CC=C(C=C1)C1(CC1)C#N
2-(Methylthio)benzoic acid, 98+%
CAS: 3724-10-5 MDL Number: MFCD00029934
Methyl 2-(methylthio)benzoate, 98%
CAS: 3704-28-7 Molecular Formula: C9H10O2S Molecular Weight (g/mol): 182.237 MDL Number: MFCD00068039 InChI Key: CPQDZXPLQXZJGF-UHFFFAOYSA-N PubChem CID: 279586 IUPAC Name: methyl 2-methylsulfanylbenzoate SMILES: COC(=O)C1=CC=CC=C1SC
3-(Trifluoromethylthio)benzoic acid, 97%
CAS: 946-65-6 Molecular Formula: C8H4F3O2S Molecular Weight (g/mol): 221.17 MDL Number: MFCD00236337 InChI Key: IVGAPIVNQABETQ-UHFFFAOYSA-M Synonym: 3-trifluoromethylthio benzoic acid,3-trifluoromethyl thio benzoic acid,3-trifluoromethyl sulfanyl benzoic acid,3-trifluoromethylsulfanyl benzoic acid,3-trifluoromethylsulfanyl-benzoic acid,benzoic acid, 3-trifluoromethyl thio,3-trifluoromethyl sulphanyl benzoic acid,3-trifluoromethylthio benzoicacid,3-carboxyphenyl trifluoromethyl sulphide PubChem CID: 688330 IUPAC Name: 3-(trifluoromethylsulfanyl)benzoic acid SMILES: [O-]C(=O)C1=CC=CC(SC(F)(F)F)=C1
(+/-)-Mandelamide, 97%
CAS: 4410-31-5 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00025495 InChI Key: MAGPZHKLEZXLNU-UHFFFAOYSA-N Synonym: mandelamide,dl-mandelamide,o-hydroxy phenylacetamide,2-hydroxy-2-phenyl-acetamide,benzeneacetamide, .alpha.-hydroxy,hydrate,-mandelamide,mandelic acid amide,+/--mandelamide PubChem CID: 73558 IUPAC Name: 2-hydroxy-2-phenylacetamide SMILES: C1=CC=C(C=C1)C(C(=O)N)O
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-Amino-5-fluorobenzamide, 97%
CAS: 63069-49-8 Molecular Formula: C7H7FN2O Molecular Weight (g/mol): 154.144 MDL Number: MFCD03428522 InChI Key: RHJMYIPLYKQZJM-UHFFFAOYSA-N PubChem CID: 10241003 IUPAC Name: 2-amino-5-fluorobenzamide SMILES: C1=CC(=C(C=C1F)C(=O)N)N
3-Fluorobenzyl chloride, 97%
CAS: 456-42-8 Molecular Formula: C7H6ClF Molecular Weight (g/mol): 144.573 MDL Number: MFCD00000904 InChI Key: XBDXMDVEZLOGMC-UHFFFAOYSA-N Synonym: 3-fluorobenzyl chloride,1-chloromethyl-3-fluorobenzene,m-fluorobenzyl chloride,benzene, 1-chloromethyl-3-fluoro,3-fluorobenzylchloride,alpha-chloro-3-fluorotoluene,alpha-chloro-m-fluorotoluene,fluorobenzyl-3 chloride,toluene, .alpha.-chloro-m-fluoro,.alpha.-chloro-m-fluorotoluene PubChem CID: 9974 IUPAC Name: 1-(chloromethyl)-3-fluorobenzene SMILES: C1=CC(=CC(=C1)F)CCl
3-Methoxybenzyl chloride, 97%
CAS: 824-98-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00000907 InChI Key: VGISFWWEOGVMED-UHFFFAOYSA-N Synonym: 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy PubChem CID: 69994 IUPAC Name: 1-(chloromethyl)-3-methoxybenzene SMILES: COC1=CC=CC(CCl)=C1
4-Chlorobenzyl bromide, 98%
CAS: 622-95-7 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.48 MDL Number: MFCD00040714 InChI Key: KQNBRMUBPRGXSL-UHFFFAOYSA-N Synonym: 4-chlorobenzyl bromide,1-bromomethyl-4-chlorobenzene,p-chlorobenzyl bromide,4-chlorobenzylbromide,benzene, 1-bromomethyl-4-chloro,alpha-bromo-4-chlorotoluene,4cbb,p-chlorobenzylbromide,4-chloro-benzylbromide PubChem CID: 69329 IUPAC Name: 1-(bromomethyl)-4-chlorobenzene SMILES: ClC1=CC=C(CBr)C=C1
alpha-Chloro-p-xylene, 98%
CAS: 104-82-5 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000919 InChI Key: DMHZDOTYAVHSEH-UHFFFAOYSA-N Synonym: 4-methylbenzyl chloride,p-xylyl chloride,1-chloromethyl-4-methylbenzene,alpha-chloro-p-xylene,p-methylbenzyl chloride,benzene, 1-chloromethyl-4-methyl,p-chloromethyl toluene,4-chloromethyl toluene,p-tolylmethyl chloride,p-xylene, alpha-chloro PubChem CID: 7722 IUPAC Name: 1-(chloromethyl)-4-methylbenzene SMILES: CC1=CC=C(C=C1)CCl
3-Nitrobenzyl bromide, 98+%
CAS: 3958-57-4 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007271 InChI Key: LNWXALCHPJANMJ-UHFFFAOYSA-N Synonym: 3-nitrobenzyl bromide,1-bromomethyl-3-nitrobenzene,m-nitrobenzyl bromide,benzene, 1-bromomethyl-3-nitro,alpha-bromo-3-nitrotoluene,m-bromomethyl nitrobenzene,alpha-bromo-m-nitrotoluene,m-nitro-alpha-bromotoluene,3-nitrobenzylbromide,toluene, alpha-bromo-m-nitro PubChem CID: 77568 IUPAC Name: 1-(bromomethyl)-3-nitrobenzene SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CBr
2-Biphenylmethanol, 98%
CAS: 2928-43-0 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.238 MDL Number: MFCD00004620 InChI Key: VKTQADPEPIVMHK-UHFFFAOYSA-N Synonym: 2-biphenylmethanol,1,1'-biphenyl-2-ylmethanol,2-phenylphenyl methanol,biphenylmethanol,2-phenylbenzyl alcohol,1,1'-biphenyl methanol,biphenyl-2-yl-methanol,2-phenylphenyl methan-1-ol,1,1'-biphenyl-2-methanol,biphenyl-2-ylmethanol PubChem CID: 76229 IUPAC Name: (2-phenylphenyl)methanol SMILES: C1=CC=C(C=C1)C2=CC=CC=C2CO
(2-Thien-2-ylphenyl)methanol, 97%, Thermo Scientific™
CAS: 773872-97-2 Molecular Formula: C11H10OS Molecular Weight (g/mol): 190.26 MDL Number: MFCD06203081 InChI Key: IUULMJAEIKVTKZ-UHFFFAOYSA-N Synonym: 2-thien-2-ylphenyl methanol,2-thiophen-2-yl phenyl methanol,2-thien-2-yl phenyl methanol,2-thiophen-2-ylphenyl methanol,2-2-thienyl phenyl methanol,benzenemethanol,2-2-thienyl,2-2-thienyl phenyl methan-1-ol PubChem CID: 2795559 SMILES: OCC1=CC=CC=C1C1=CC=CS1