Benzenoids
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N-Methyl-N-[3-(pyridin-2-yloxy)benzyl]amine, 97%, Thermo Scientific™
CAS: 871825-60-4 Molecular Formula: C13H14N2O Molecular Weight (g/mol): 214.27 MDL Number: MFCD09025856 InChI Key: OEPWSCXLHMBFPC-UHFFFAOYSA-N Synonym: n-methyl-n-3-pyridin-2-yloxy benzyl amine,methyl 3-pyridin-2-yloxy phenyl methyl amine,methyl 3-2-pyridyloxy phenyl methyl amine,benzenemethanamine,n-methyl-3-2-pyridinyloxy,n-methyl-1-3-pyridin-2-yloxy phenyl methanamine,n-methyl-1-3-pyridin-2-yl oxy phenyl methanamine PubChem CID: 18525840 IUPAC Name: N-methyl-1-(3-pyridin-2-yloxyphenyl)methanamine SMILES: CNCC1=CC(OC2=CC=CC=N2)=CC=C1
| PubChem CID | 18525840 |
|---|---|
| CAS | 871825-60-4 |
| Molecular Weight (g/mol) | 214.27 |
| MDL Number | MFCD09025856 |
| SMILES | CNCC1=CC(OC2=CC=CC=N2)=CC=C1 |
| Synonym | n-methyl-n-3-pyridin-2-yloxy benzyl amine,methyl 3-pyridin-2-yloxy phenyl methyl amine,methyl 3-2-pyridyloxy phenyl methyl amine,benzenemethanamine,n-methyl-3-2-pyridinyloxy,n-methyl-1-3-pyridin-2-yloxy phenyl methanamine,n-methyl-1-3-pyridin-2-yl oxy phenyl methanamine |
| IUPAC Name | N-methyl-1-(3-pyridin-2-yloxyphenyl)methanamine |
| InChI Key | OEPWSCXLHMBFPC-UHFFFAOYSA-N |
| Molecular Formula | C13H14N2O |
2,5-Dibromotoluene, 98%
CAS: 615-59-8 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.933 MDL Number: MFCD00000090 InChI Key: QKEZTJYRBHOKHH-UHFFFAOYSA-N Synonym: 2,5-dibromotoluene,benzene, 1,4-dibromo-2-methyl,toluene, 2,5-dibromo,2,5-dibromo toluene,3,6-dibromotoluene,1,4-dibromo-2-methyl-benzene,pubchem3922,acmc-209mu2,chemwish ic06904 PubChem CID: 12006 IUPAC Name: 1,4-dibromo-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)Br
| PubChem CID | 12006 |
|---|---|
| CAS | 615-59-8 |
| Molecular Weight (g/mol) | 249.933 |
| MDL Number | MFCD00000090 |
| SMILES | CC1=C(C=CC(=C1)Br)Br |
| Synonym | 2,5-dibromotoluene,benzene, 1,4-dibromo-2-methyl,toluene, 2,5-dibromo,2,5-dibromo toluene,3,6-dibromotoluene,1,4-dibromo-2-methyl-benzene,pubchem3922,acmc-209mu2,chemwish ic06904 |
| IUPAC Name | 1,4-dibromo-2-methylbenzene |
| InChI Key | QKEZTJYRBHOKHH-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2 |
Aspirin, USP, 99.5-100.5%, Spectrum™ Chemical
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CAS: 50-78-2 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002430 InChI Key: BSYNRYMUTXBXSQ-UHFFFAOYSA-N IUPAC Name: 2-(acetyloxy)benzoic acid SMILES: CC(=O)OC1=CC=CC=C1C(O)=O
| CAS | 50-78-2 |
|---|---|
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00002430 |
| SMILES | CC(=O)OC1=CC=CC=C1C(O)=O |
| IUPAC Name | 2-(acetyloxy)benzoic acid |
| InChI Key | BSYNRYMUTXBXSQ-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
Basic Fuchsin, Spectrum™ Chemical
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CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.82 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N IUPAC Name: hydrogen 4-[(4-aminophenyl)(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline chloride SMILES: [H+].[Cl-].NC1=CC=C(C=C1)C(C1=CC=C(N)C=C1)=C1C=CC(=N)C=C1
| CAS | 569-61-9 |
|---|---|
| Molecular Weight (g/mol) | 323.82 |
| SMILES | [H+].[Cl-].NC1=CC=C(C=C1)C(C1=CC=C(N)C=C1)=C1C=CC(=N)C=C1 |
| IUPAC Name | hydrogen 4-[(4-aminophenyl)(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline chloride |
| InChI Key | JUQPZRLQQYSMEQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18ClN3 |
1-Bromo-4-cyclohexylbenzene, 98%
CAS: 25109-28-8 Molecular Formula: C12H15Br Molecular Weight (g/mol): 239.156 MDL Number: MFCD00019339 InChI Key: LVIJLEREXMVRAN-UHFFFAOYSA-N Synonym: p-bromocyclohexylbenzene,1-brom-4-cyclohexylbenzol,zlchem 88,4-cyclohexylbromobenzene,4-bromophenylcyclohexane,acmc-1ccsm,4-bromo-1-cyclohexylbenzene,1-bromo-4-cyclohexyl-benzene,benzene, 1-bromo-4-cyclohexyl,lvijlerexmvran-uhfffaoysa PubChem CID: 90718 IUPAC Name: 1-bromo-4-cyclohexylbenzene SMILES: C1CCC(CC1)C2=CC=C(C=C2)Br
| PubChem CID | 90718 |
|---|---|
| CAS | 25109-28-8 |
| Molecular Weight (g/mol) | 239.156 |
| MDL Number | MFCD00019339 |
| SMILES | C1CCC(CC1)C2=CC=C(C=C2)Br |
| Synonym | p-bromocyclohexylbenzene,1-brom-4-cyclohexylbenzol,zlchem 88,4-cyclohexylbromobenzene,4-bromophenylcyclohexane,acmc-1ccsm,4-bromo-1-cyclohexylbenzene,1-bromo-4-cyclohexyl-benzene,benzene, 1-bromo-4-cyclohexyl,lvijlerexmvran-uhfffaoysa |
| IUPAC Name | 1-bromo-4-cyclohexylbenzene |
| InChI Key | LVIJLEREXMVRAN-UHFFFAOYSA-N |
| Molecular Formula | C12H15Br |
Dibenzenesulfonamide, 95%
CAS: 2618-96-4 Molecular Formula: C12H11NO4S2 Molecular Weight (g/mol): 297.343 MDL Number: MFCD00025019 InChI Key: OVQABVAKPIYHIG-UHFFFAOYSA-N Synonym: dibenzenesulfonimide,benzenesulfonamide, n-phenylsulfonyl,dibenzenesulfonamide,bis phenylsulfonyl amine,n-phenylsulfonyl benzenesulfonamide,dibenzolsulfimid,dibenzolsulfimide,diphenylsulfonimide,benzenesulfonic acid imide,n-benzenesulfonyl benzenesulfonamide PubChem CID: 75671 IUPAC Name: N-(benzenesulfonyl)benzenesulfonamide SMILES: C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2
| PubChem CID | 75671 |
|---|---|
| CAS | 2618-96-4 |
| Molecular Weight (g/mol) | 297.343 |
| MDL Number | MFCD00025019 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2 |
| Synonym | dibenzenesulfonimide,benzenesulfonamide, n-phenylsulfonyl,dibenzenesulfonamide,bis phenylsulfonyl amine,n-phenylsulfonyl benzenesulfonamide,dibenzolsulfimid,dibenzolsulfimide,diphenylsulfonimide,benzenesulfonic acid imide,n-benzenesulfonyl benzenesulfonamide |
| IUPAC Name | N-(benzenesulfonyl)benzenesulfonamide |
| InChI Key | OVQABVAKPIYHIG-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO4S2 |
4-(2-Iodophenoxy)tetrahydropyran, 97%, Thermo Scientific™
CAS: 906352-70-3 Molecular Formula: C11H13IO2 Molecular Weight (g/mol): 304.127 MDL Number: MFCD09064961 InChI Key: ADTBIBCNKWWYRD-UHFFFAOYSA-N Synonym: 4-2-iodophenoxy tetrahydropyran,4-2-iodophenoxy oxane,4-2-iodophenoxy tetrahydro-2h-pyran PubChem CID: 21981312 IUPAC Name: 4-(2-iodophenoxy)oxane SMILES: C1COCCC1OC2=CC=CC=C2I
| PubChem CID | 21981312 |
|---|---|
| CAS | 906352-70-3 |
| Molecular Weight (g/mol) | 304.127 |
| MDL Number | MFCD09064961 |
| SMILES | C1COCCC1OC2=CC=CC=C2I |
| Synonym | 4-2-iodophenoxy tetrahydropyran,4-2-iodophenoxy oxane,4-2-iodophenoxy tetrahydro-2h-pyran |
| IUPAC Name | 4-(2-iodophenoxy)oxane |
| InChI Key | ADTBIBCNKWWYRD-UHFFFAOYSA-N |
| Molecular Formula | C11H13IO2 |
| CAS | 6320-02-1 |
|---|---|
| MDL Number | MFCD00004827 |
1-Bromo-2-chloro-4-fluorobenzene, 98%, Thermo Scientific Chemicals
CAS: 110407-59-5 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.442 MDL Number: MFCD00142587 InChI Key: LEFQPBAWVJEIJS-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobromobenzene,4-bromo-3-chloro-1-fluorobenzene,1-bromo-2-chloro-4-fluoro-benzene,4-bromo-3-chlorofluorobenzene,2-bromo-5-fluorochlorobenzene,benzene, 1-bromo-2-chloro-4-fluoro,pubchem3755,acmc-1bnv0,2-chloro-4-fluorobromobezene,ksc494m7f PubChem CID: 2733406 IUPAC Name: 1-bromo-2-chloro-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)Cl)Br
| PubChem CID | 2733406 |
|---|---|
| CAS | 110407-59-5 |
| Molecular Weight (g/mol) | 209.442 |
| MDL Number | MFCD00142587 |
| SMILES | C1=CC(=C(C=C1F)Cl)Br |
| Synonym | 2-chloro-4-fluorobromobenzene,4-bromo-3-chloro-1-fluorobenzene,1-bromo-2-chloro-4-fluoro-benzene,4-bromo-3-chlorofluorobenzene,2-bromo-5-fluorochlorobenzene,benzene, 1-bromo-2-chloro-4-fluoro,pubchem3755,acmc-1bnv0,2-chloro-4-fluorobromobezene,ksc494m7f |
| IUPAC Name | 1-bromo-2-chloro-4-fluorobenzene |
| InChI Key | LEFQPBAWVJEIJS-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClF |
4-Chloro-3,5-dinitrobenzoic acid, 97%
CAS: 118-97-8 Molecular Formula: C7H3ClN2O6 Molecular Weight (g/mol): 246.559 MDL Number: MFCD00007080 InChI Key: PCTFIHOVQYYAMH-UHFFFAOYSA-N Synonym: 4-chloro-3,5-dinitrobenzoic acid,3,5-dinitro-4-chlorobenzoic acid,benzoic acid, 4-chloro-3,5-dinitro,4-chloro-3,5-dinitrobenzoate,4-chloro-3,5-dinitro-benzoic acid,benzoicacid, 4-chloro-3,5-dinitro,pubchem22980,acmc-1bt9j,ksc180k5t,timtec-bb sbb003176 PubChem CID: 8377 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)O
| PubChem CID | 8377 |
|---|---|
| CAS | 118-97-8 |
| Molecular Weight (g/mol) | 246.559 |
| MDL Number | MFCD00007080 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)O |
| Synonym | 4-chloro-3,5-dinitrobenzoic acid,3,5-dinitro-4-chlorobenzoic acid,benzoic acid, 4-chloro-3,5-dinitro,4-chloro-3,5-dinitrobenzoate,4-chloro-3,5-dinitro-benzoic acid,benzoicacid, 4-chloro-3,5-dinitro,pubchem22980,acmc-1bt9j,ksc180k5t,timtec-bb sbb003176 |
| InChI Key | PCTFIHOVQYYAMH-UHFFFAOYSA-N |
| Molecular Formula | C7H3ClN2O6 |
2-(Methylthio)phenylboronic acid, 97%, Thermo Scientific™
CAS: 168618-42-6 Molecular Formula: C7H9BO2S Molecular Weight (g/mol): 168.02 MDL Number: MFCD01318165 InChI Key: QXBWTYBCNFKURT-UHFFFAOYSA-N Synonym: 2-methylthio phenylboronic acid,2-methylthiophenylboronic acid,2-methylthio phenyl boronic acid,2-methylthio benzeneboronic acid,2-thioanisoleboronic acid,2-methylsulfanylphenyl boronic acid,2-methylsulfanyl phenylboronic acid,2-methylsulfanyl phenyl boranediol,2-methylsulfanyl phenyl boronic acid,o-methylthio phenylboronic acid PubChem CID: 2773543 SMILES: CSC1=CC=CC=C1B(O)O
| PubChem CID | 2773543 |
|---|---|
| CAS | 168618-42-6 |
| Molecular Weight (g/mol) | 168.02 |
| MDL Number | MFCD01318165 |
| SMILES | CSC1=CC=CC=C1B(O)O |
| Synonym | 2-methylthio phenylboronic acid,2-methylthiophenylboronic acid,2-methylthio phenyl boronic acid,2-methylthio benzeneboronic acid,2-thioanisoleboronic acid,2-methylsulfanylphenyl boronic acid,2-methylsulfanyl phenylboronic acid,2-methylsulfanyl phenyl boranediol,2-methylsulfanyl phenyl boronic acid,o-methylthio phenylboronic acid |
| InChI Key | QXBWTYBCNFKURT-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO2S |
5-Chloro-2-hydroxybenzamide, 97%
CAS: 7120-43-6 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007980 InChI Key: NNHMQZBVJPQCAK-UHFFFAOYSA-N Synonym: 5-chlorosalicylamide,chlorosalicylamide,benzamide, 5-chloro-2-hydroxy,5-chlorosalicyl-amide,acmc-209ohl,5chloro-2-hydroxy-benzamide,ksc498a5j,5-chloro-2-hydroxy-benzamide,#,5-chloranyl-2-oxidanyl-benzamide PubChem CID: 348094 IUPAC Name: 5-chloro-2-hydroxybenzamide SMILES: NC(=O)C1=CC(Cl)=CC=C1O
| PubChem CID | 348094 |
|---|---|
| CAS | 7120-43-6 |
| Molecular Weight (g/mol) | 171.58 |
| MDL Number | MFCD00007980 |
| SMILES | NC(=O)C1=CC(Cl)=CC=C1O |
| Synonym | 5-chlorosalicylamide,chlorosalicylamide,benzamide, 5-chloro-2-hydroxy,5-chlorosalicyl-amide,acmc-209ohl,5chloro-2-hydroxy-benzamide,ksc498a5j,5-chloro-2-hydroxy-benzamide,#,5-chloranyl-2-oxidanyl-benzamide |
| IUPAC Name | 5-chloro-2-hydroxybenzamide |
| InChI Key | NNHMQZBVJPQCAK-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO2 |
4-Fluorobenzylamine, 98+%
CAS: 140-75-0 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.146 MDL Number: MFCD00008120 InChI Key: IIFVWLUQBAIPMJ-UHFFFAOYSA-N Synonym: 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 PubChem CID: 67326 IUPAC Name: (4-fluorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)F
| PubChem CID | 67326 |
|---|---|
| CAS | 140-75-0 |
| Molecular Weight (g/mol) | 125.146 |
| MDL Number | MFCD00008120 |
| SMILES | C1=CC(=CC=C1CN)F |
| Synonym | 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 |
| IUPAC Name | (4-fluorophenyl)methanamine |
| InChI Key | IIFVWLUQBAIPMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |
Cyclopropyl phenyl sulfide, 98+%
CAS: 14633-54-6 Molecular Formula: C9H10S Molecular Weight (g/mol): 150.24 MDL Number: MFCD00009684 InChI Key: YIBKCPJOFAUAKY-UHFFFAOYSA-N Synonym: cyclopropyl phenyl sulfide,cyclopropyl phenyl sulfane,cyclopropylsulfanyl benzene,benzene, cyclopropylthio,cyclopropylphenylsulfide,cyclopropyl phenyl sulphide,unii-72c99lp48p,cyclopropylsulfanyl-benzene,pubchem10736,cyclopropylphenyl sulfide PubChem CID: 123348 IUPAC Name: cyclopropylsulfanylbenzene SMILES: C1CC1SC1=CC=CC=C1
| PubChem CID | 123348 |
|---|---|
| CAS | 14633-54-6 |
| Molecular Weight (g/mol) | 150.24 |
| MDL Number | MFCD00009684 |
| SMILES | C1CC1SC1=CC=CC=C1 |
| Synonym | cyclopropyl phenyl sulfide,cyclopropyl phenyl sulfane,cyclopropylsulfanyl benzene,benzene, cyclopropylthio,cyclopropylphenylsulfide,cyclopropyl phenyl sulphide,unii-72c99lp48p,cyclopropylsulfanyl-benzene,pubchem10736,cyclopropylphenyl sulfide |
| IUPAC Name | cyclopropylsulfanylbenzene |
| InChI Key | YIBKCPJOFAUAKY-UHFFFAOYSA-N |
| Molecular Formula | C9H10S |
3,5-Bis(trifluoromethyl)benzonitrile, 97%
CAS: 27126-93-8 Molecular Formula: C9H3F6N Molecular Weight (g/mol): 239.12 MDL Number: MFCD00000379 InChI Key: CZKHHAOIHXHOSR-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzonitrile,3,5-di trifluoromethyl benzonitrile,bis 3,5-trifluoromethyl benzonitrile,mbt-cn,3,5-bis-trifluoromethyl benzonitrile,benzonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzenecarbonitrile,fxffr ccn exfff,pubchem4691,3,5-bis tifluoromethyl-1-cyanobenzene PubChem CID: 96746 IUPAC Name: 3,5-bis(trifluoromethyl)benzonitrile SMILES: FC(F)(F)C1=CC(=CC(=C1)C#N)C(F)(F)F
| PubChem CID | 96746 |
|---|---|
| CAS | 27126-93-8 |
| Molecular Weight (g/mol) | 239.12 |
| MDL Number | MFCD00000379 |
| SMILES | FC(F)(F)C1=CC(=CC(=C1)C#N)C(F)(F)F |
| Synonym | 3,5-bis trifluoromethyl benzonitrile,3,5-di trifluoromethyl benzonitrile,bis 3,5-trifluoromethyl benzonitrile,mbt-cn,3,5-bis-trifluoromethyl benzonitrile,benzonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzenecarbonitrile,fxffr ccn exfff,pubchem4691,3,5-bis tifluoromethyl-1-cyanobenzene |
| IUPAC Name | 3,5-bis(trifluoromethyl)benzonitrile |
| InChI Key | CZKHHAOIHXHOSR-UHFFFAOYSA-N |
| Molecular Formula | C9H3F6N |