Benzene and substituted derivatives
Filtered Search Results
[NH2Me2][(RuCl((S)-binap))2(mu-Cl)3], TCI America™
CAS: 199541-17-8 Molecular Formula: C90H78Cl5NP4Ru2+2 Molecular Weight (g/mol): 1676.906 MDL Number: MFCD09753033 InChI Key: IDNUVQHPQCZKMV-UHFFFAOYSA-M Synonym: Dimethylammonium Dichlorotri(mu-chloro)bis[(S)-(-)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]diruthenate(II) PubChem CID: 132472188 IUPAC Name: trichloranium;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;N-methylmethanamine;ruthenium;chloride;hydrochloride SMILES: CNC.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.[ClH2+].[ClH2+].[ClH2+].Cl.[Cl-].[Ru].[Ru]
| PubChem CID | 132472188 |
|---|---|
| CAS | 199541-17-8 |
| Molecular Weight (g/mol) | 1676.906 |
| MDL Number | MFCD09753033 |
| SMILES | CNC.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.[ClH2+].[ClH2+].[ClH2+].Cl.[Cl-].[Ru].[Ru] |
| Synonym | Dimethylammonium Dichlorotri(mu-chloro)bis[(S)-(-)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]diruthenate(II) |
| IUPAC Name | trichloranium;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;N-methylmethanamine;ruthenium;chloride;hydrochloride |
| InChI Key | IDNUVQHPQCZKMV-UHFFFAOYSA-M |
| Molecular Formula | C90H78Cl5NP4Ru2+2 |
1-Bromo-2,3,5-trifluorobenzene 98.0+%, TCI America™
CAS: 133739-70-5 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.98 MDL Number: MFCD00012232 InChI Key: XSMLLZPSNLQCQU-UHFFFAOYSA-N PubChem CID: 2736399 IUPAC Name: 1-bromo-2,3,5-trifluorobenzene SMILES: FC1=CC(F)=C(F)C(Br)=C1
| PubChem CID | 2736399 |
|---|---|
| CAS | 133739-70-5 |
| Molecular Weight (g/mol) | 210.98 |
| MDL Number | MFCD00012232 |
| SMILES | FC1=CC(F)=C(F)C(Br)=C1 |
| IUPAC Name | 1-bromo-2,3,5-trifluorobenzene |
| InChI Key | XSMLLZPSNLQCQU-UHFFFAOYSA-N |
| Molecular Formula | C6H2BrF3 |
Tetraethylammonium p-Toluenesulfonate 98.0+%, TCI America™
CAS: 733-44-8 Molecular Formula: C15H27NO3S Molecular Weight (g/mol): 301.445 MDL Number: MFCD00011831 InChI Key: QKFFSWPNFCXGIQ-UHFFFAOYSA-M Synonym: tetraethylammonium p-toluenesulfonate,tetraethylammonium tosylate,ethanaminium, n,n,n-triethyl-, salt with 4-methylbenzenesulfonic acid 1:1,tetraethylammonium 4-methylbenzenesulfonate,ethanaminium, n,n,n-triethyl-, 4-methylbenzenesulfonate 1:1,4-methylbenzenesulfonate; tetraethylazanium,et4nots,tetraethylammonium p-toluenesulphonate,acmc-209oql,n,n,n-triethylethanaminium-4-methylbenzolsulfonat PubChem CID: 101846 IUPAC Name: 4-methylbenzenesulfonate;tetraethylazanium SMILES: CC[N+](CC)(CC)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-]
| PubChem CID | 101846 |
|---|---|
| CAS | 733-44-8 |
| Molecular Weight (g/mol) | 301.445 |
| MDL Number | MFCD00011831 |
| SMILES | CC[N+](CC)(CC)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-] |
| Synonym | tetraethylammonium p-toluenesulfonate,tetraethylammonium tosylate,ethanaminium, n,n,n-triethyl-, salt with 4-methylbenzenesulfonic acid 1:1,tetraethylammonium 4-methylbenzenesulfonate,ethanaminium, n,n,n-triethyl-, 4-methylbenzenesulfonate 1:1,4-methylbenzenesulfonate; tetraethylazanium,et4nots,tetraethylammonium p-toluenesulphonate,acmc-209oql,n,n,n-triethylethanaminium-4-methylbenzolsulfonat |
| IUPAC Name | 4-methylbenzenesulfonate;tetraethylazanium |
| InChI Key | QKFFSWPNFCXGIQ-UHFFFAOYSA-M |
| Molecular Formula | C15H27NO3S |
3,4,5-Trifluorobenzoic Acid 98.0+%, TCI America™
CAS: 121602-93-5 Molecular Formula: C7H3F3O2 Molecular Weight (g/mol): 176.094 MDL Number: MFCD00074962 InChI Key: VJMYKESYFHYUEQ-UHFFFAOYSA-N Synonym: 3,4,5-trifluorobenzoicacid,benzoic acid, 3,4,5-trifluoro,3,4,5-trifluoro benzoic acid,3,4,5-trifluoro-benzoic acid,acmc-209aen,ksc177i9t,rarechem al bo 0682,3,4,5-trifluorobenzoyl alcohol,buttpark 30\01-46 PubChem CID: 853154 IUPAC Name: 3,4,5-trifluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)F)F)C(=O)O
| PubChem CID | 853154 |
|---|---|
| CAS | 121602-93-5 |
| Molecular Weight (g/mol) | 176.094 |
| MDL Number | MFCD00074962 |
| SMILES | C1=C(C=C(C(=C1F)F)F)C(=O)O |
| Synonym | 3,4,5-trifluorobenzoicacid,benzoic acid, 3,4,5-trifluoro,3,4,5-trifluoro benzoic acid,3,4,5-trifluoro-benzoic acid,acmc-209aen,ksc177i9t,rarechem al bo 0682,3,4,5-trifluorobenzoyl alcohol,buttpark 30\01-46 |
| IUPAC Name | 3,4,5-trifluorobenzoic acid |
| InChI Key | VJMYKESYFHYUEQ-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3O2 |
Ambrisentan 98.0+%, TCI America™
CAS: 177036-94-1 Molecular Formula: C22H22N2O4 Molecular Weight (g/mol): 378.43 MDL Number: MFCD08672619 InChI Key: OUJTZYPIHDYQMC-UHFFFAOYNA-N Synonym: (S)-2-[(4,6-Dimethylpyrimidin-2-yl)oxy]-3-methoxy-3,3-diphenylpropionic Acid PubChem CID: 6918493 IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)oxy]-3-methoxy-3,3-diphenylpropanoic acid SMILES: COC(C(OC1=NC(C)=CC(C)=N1)C(O)=O)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 6918493 |
|---|---|
| CAS | 177036-94-1 |
| Molecular Weight (g/mol) | 378.43 |
| MDL Number | MFCD08672619 |
| SMILES | COC(C(OC1=NC(C)=CC(C)=N1)C(O)=O)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | (S)-2-[(4,6-Dimethylpyrimidin-2-yl)oxy]-3-methoxy-3,3-diphenylpropionic Acid |
| IUPAC Name | 2-[(4,6-dimethylpyrimidin-2-yl)oxy]-3-methoxy-3,3-diphenylpropanoic acid |
| InChI Key | OUJTZYPIHDYQMC-UHFFFAOYNA-N |
| Molecular Formula | C22H22N2O4 |
o-Toluidine 99.0+%, TCI America™
CAS: 95-53-4 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00007730 InChI Key: RNVCVTLRINQCPJ-UHFFFAOYSA-N Synonym: o-toluidine,2-toluidine,o-tolylamine,2-aminotoluene,2-methylbenzenamine,ortho-toluidine,o-methylaniline,benzenamine, 2-methyl,o-aminotoluene,o-methylbenzenamine PubChem CID: 7242 ChEBI: CHEBI:66892 IUPAC Name: 2-methylaniline SMILES: CC1=CC=CC=C1N
| PubChem CID | 7242 |
|---|---|
| CAS | 95-53-4 |
| Molecular Weight (g/mol) | 107.156 |
| ChEBI | CHEBI:66892 |
| MDL Number | MFCD00007730 |
| SMILES | CC1=CC=CC=C1N |
| Synonym | o-toluidine,2-toluidine,o-tolylamine,2-aminotoluene,2-methylbenzenamine,ortho-toluidine,o-methylaniline,benzenamine, 2-methyl,o-aminotoluene,o-methylbenzenamine |
| IUPAC Name | 2-methylaniline |
| InChI Key | RNVCVTLRINQCPJ-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |
3,4,5-Trimethoxybenzyl Alcohol 98.0+%, TCI America™
CAS: 3840-31-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00004639 InChI Key: QPHLRCUCFDXGLY-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxybenzyl alcohol,3,4,5-trimethoxyphenyl methanol,benzenemethanol, 3,4,5-trimethoxy,3,4,5-trimethoxybenzylalcohol,3,4,5-trimethoxybenzylic alcohol,benzyl alcohol, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methan-1-ol,acmc-1cp7y,3,4,5-trimethoxybenzalcohol,ksc494s0n PubChem CID: 77449 IUPAC Name: (3,4,5-trimethoxyphenyl)methanol SMILES: COC1=CC(=CC(=C1OC)OC)CO
| PubChem CID | 77449 |
|---|---|
| CAS | 3840-31-1 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00004639 |
| SMILES | COC1=CC(=CC(=C1OC)OC)CO |
| Synonym | 3,4,5-trimethoxybenzyl alcohol,3,4,5-trimethoxyphenyl methanol,benzenemethanol, 3,4,5-trimethoxy,3,4,5-trimethoxybenzylalcohol,3,4,5-trimethoxybenzylic alcohol,benzyl alcohol, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methan-1-ol,acmc-1cp7y,3,4,5-trimethoxybenzalcohol,ksc494s0n |
| IUPAC Name | (3,4,5-trimethoxyphenyl)methanol |
| InChI Key | QPHLRCUCFDXGLY-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
2,4,6-Triisopropylbenzenesulfonyl Chloride 97.0+%, TCI America™
CAS: 6553-96-4 Molecular Formula: C15H23ClO2S Molecular Weight (g/mol): 302.857 MDL Number: MFCD00007433 InChI Key: JAPYIBBSTJFDAK-UHFFFAOYSA-N Synonym: 2,4,6-triisopropylbenzenesulfonyl chloride,2,4,6-triisopropylbenzene-1-sulfonyl chloride,trisyl chloride,2,4,6-triisopropylbenzenesulphonyl chloride,benzenesulfonyl chloride, 2,4,6-tris 1-methylethyl,2,4,6-triisopropylbenzenesulfonylchloride,2,4,6-triisopropyl-benzenesulfonyl chloride,tpscl 2,4,6-triisopropyl benzenesulfonyl chloride,2,4,6-triisopropylphenylsulfonyl chloride,2,4,6-triisopropyl benzenesulfonyl chloride PubChem CID: 81042 IUPAC Name: 2,4,6-tri(propan-2-yl)benzenesulfonyl chloride SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)Cl)C(C)C
| PubChem CID | 81042 |
|---|---|
| CAS | 6553-96-4 |
| Molecular Weight (g/mol) | 302.857 |
| MDL Number | MFCD00007433 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)Cl)C(C)C |
| Synonym | 2,4,6-triisopropylbenzenesulfonyl chloride,2,4,6-triisopropylbenzene-1-sulfonyl chloride,trisyl chloride,2,4,6-triisopropylbenzenesulphonyl chloride,benzenesulfonyl chloride, 2,4,6-tris 1-methylethyl,2,4,6-triisopropylbenzenesulfonylchloride,2,4,6-triisopropyl-benzenesulfonyl chloride,tpscl 2,4,6-triisopropyl benzenesulfonyl chloride,2,4,6-triisopropylphenylsulfonyl chloride,2,4,6-triisopropyl benzenesulfonyl chloride |
| IUPAC Name | 2,4,6-tri(propan-2-yl)benzenesulfonyl chloride |
| InChI Key | JAPYIBBSTJFDAK-UHFFFAOYSA-N |
| Molecular Formula | C15H23ClO2S |
2,3,6-Trichlorobenzaldehyde 97.0+%, TCI America™
CAS: 4659-47-6 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00010216 InChI Key: AURSMWWOMOVHBM-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3,6-trichloro,unii-q065lqh643,2,3,6-trichloro benzaldehyde,pubchem17003,acmc-1apnu,2,3,6-trichlorbenzaldehyd,4-07-00-00577 beilstein handbook reference,ksc497o2d,aurora 4807,benzaldehyde,2,3,6-trichloro PubChem CID: 20781 IUPAC Name: 2,3,6-trichlorobenzaldehyde SMILES: C1=CC(=C(C(=C1Cl)C=O)Cl)Cl
| PubChem CID | 20781 |
|---|---|
| CAS | 4659-47-6 |
| Molecular Weight (g/mol) | 209.45 |
| MDL Number | MFCD00010216 |
| SMILES | C1=CC(=C(C(=C1Cl)C=O)Cl)Cl |
| Synonym | benzaldehyde, 2,3,6-trichloro,unii-q065lqh643,2,3,6-trichloro benzaldehyde,pubchem17003,acmc-1apnu,2,3,6-trichlorbenzaldehyd,4-07-00-00577 beilstein handbook reference,ksc497o2d,aurora 4807,benzaldehyde,2,3,6-trichloro |
| IUPAC Name | 2,3,6-trichlorobenzaldehyde |
| InChI Key | AURSMWWOMOVHBM-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl3O |
3,4,5,6-Tetrafluorosalicylic Acid 98.0+%, TCI America™
CAS: 14742-36-0 Molecular Formula: C7H2F4O3 Molecular Weight (g/mol): 210.08 MDL Number: MFCD00483242 InChI Key: WKYGDMSOKGXAAY-UHFFFAOYSA-N Synonym: 3,4,5,6-Tetrafluoro-2-hydroxybenzoic Acid PubChem CID: 11020133 IUPAC Name: 2,3,4,5-tetrafluoro-6-hydroxybenzoic acid SMILES: OC(=O)C1=C(O)C(F)=C(F)C(F)=C1F
| PubChem CID | 11020133 |
|---|---|
| CAS | 14742-36-0 |
| Molecular Weight (g/mol) | 210.08 |
| MDL Number | MFCD00483242 |
| SMILES | OC(=O)C1=C(O)C(F)=C(F)C(F)=C1F |
| Synonym | 3,4,5,6-Tetrafluoro-2-hydroxybenzoic Acid |
| IUPAC Name | 2,3,4,5-tetrafluoro-6-hydroxybenzoic acid |
| InChI Key | WKYGDMSOKGXAAY-UHFFFAOYSA-N |
| Molecular Formula | C7H2F4O3 |
2,4,6-Trifluorobenzonitrile 98.0+%, TCI America™
CAS: 96606-37-0 Molecular Formula: C7H2F3N Molecular Weight (g/mol): 157.095 MDL Number: MFCD00042399 InChI Key: HTKFGTCCOJIUIK-UHFFFAOYSA-N Synonym: benzonitrile, 2,4,6-trifluoro,2,4,6-trifluorobenzenecarbonitrile,ncr bf df ff,pubchem1565,acmc-209s7e,ksc488g9f,2,4,6-trifluoro-benzonitrile,2,4,6-trifluorobenzonitrile,benzonitrile, 2,4,6-trifluoro-, radical ion 1-9ci PubChem CID: 737177 IUPAC Name: 2,4,6-trifluorobenzonitrile SMILES: C1=C(C=C(C(=C1F)C#N)F)F
| PubChem CID | 737177 |
|---|---|
| CAS | 96606-37-0 |
| Molecular Weight (g/mol) | 157.095 |
| MDL Number | MFCD00042399 |
| SMILES | C1=C(C=C(C(=C1F)C#N)F)F |
| Synonym | benzonitrile, 2,4,6-trifluoro,2,4,6-trifluorobenzenecarbonitrile,ncr bf df ff,pubchem1565,acmc-209s7e,ksc488g9f,2,4,6-trifluoro-benzonitrile,2,4,6-trifluorobenzonitrile,benzonitrile, 2,4,6-trifluoro-, radical ion 1-9ci |
| IUPAC Name | 2,4,6-trifluorobenzonitrile |
| InChI Key | HTKFGTCCOJIUIK-UHFFFAOYSA-N |
| Molecular Formula | C7H2F3N |
2,3,4,5-Tetrafluorobenzonitrile 97.0+%, TCI America™
CAS: 16582-93-7 Molecular Formula: C7HF4N Molecular Weight (g/mol): 175.09 MDL Number: MFCD00040187 InChI Key: GLTGXIGJLCSEAM-UHFFFAOYSA-N Synonym: 2,3,4,5-tetrafluorobenzenecarbonitrile,tetrafluorobenzonitrile,pubchem9013,intermediates-zcf02243,acmc-1c97m,gltgxigjlcseam-uhfffaoysa,2,3,4,5-tetrafluorobenzonitrile_x000d_,2,3,4,5-tetrakis fluoranyl benzenecarbonitrile PubChem CID: 600224 IUPAC Name: 2,3,4,5-tetrafluorobenzonitrile SMILES: FC1=CC(C#N)=C(F)C(F)=C1F
| PubChem CID | 600224 |
|---|---|
| CAS | 16582-93-7 |
| Molecular Weight (g/mol) | 175.09 |
| MDL Number | MFCD00040187 |
| SMILES | FC1=CC(C#N)=C(F)C(F)=C1F |
| Synonym | 2,3,4,5-tetrafluorobenzenecarbonitrile,tetrafluorobenzonitrile,pubchem9013,intermediates-zcf02243,acmc-1c97m,gltgxigjlcseam-uhfffaoysa,2,3,4,5-tetrafluorobenzonitrile_x000d_,2,3,4,5-tetrakis fluoranyl benzenecarbonitrile |
| IUPAC Name | 2,3,4,5-tetrafluorobenzonitrile |
| InChI Key | GLTGXIGJLCSEAM-UHFFFAOYSA-N |
| Molecular Formula | C7HF4N |
| PubChem CID | 2734388 |
|---|---|
| CAS | 1423-26-3 |
| MDL Number | MFCD00151854 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| Chemical Name or Material | 3-(Trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride) |
| TSCA | No |
| IUPAC Name | [3-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | WOAORAPRPVIATR-UHFFFAOYSA-N |
| Molecular Formula | C7H6BF3O2 |
| Formula Weight | 189.93 |
Tetrafluoroisophthalamide 94.0+%, TCI America™
CAS: 153279-27-7 Molecular Formula: C8H4F4N2O2 Molecular Weight (g/mol): 236.126 InChI Key: JDNPZWSPPAVPPP-UHFFFAOYSA-N Synonym: Tetrafluoro-m-phthalamide PubChem CID: 11172398 IUPAC Name: 2,4,5,6-tetrafluorobenzene-1,3-dicarboxamide SMILES: C1(=C(C(=C(C(=C1F)F)F)C(=O)N)F)C(=O)N
| PubChem CID | 11172398 |
|---|---|
| CAS | 153279-27-7 |
| Molecular Weight (g/mol) | 236.126 |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)C(=O)N)F)C(=O)N |
| Synonym | Tetrafluoro-m-phthalamide |
| IUPAC Name | 2,4,5,6-tetrafluorobenzene-1,3-dicarboxamide |
| InChI Key | JDNPZWSPPAVPPP-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4N2O2 |
o-Acetotoluidine 98.0+%, TCI America™
CAS: 120-66-1 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 MDL Number: MFCD00014961 InChI Key: BPEXTIMJLDWDTL-UHFFFAOYSA-N Synonym: o-acetotoluidide,2'-methylacetanilide,n-o-tolyl acetamide,n-2-methylphenyl acetamide,acetyl-o-toluidine,n-acetyl-o-toluidine,o-acetotoluide,acetamide, n-2-methylphenyl,o-methylacetanilide,n-o-tolylacetamide PubChem CID: 8443 IUPAC Name: N-(2-methylphenyl)acetamide SMILES: CC1=CC=CC=C1NC(=O)C
| PubChem CID | 8443 |
|---|---|
| CAS | 120-66-1 |
| Molecular Weight (g/mol) | 149.193 |
| MDL Number | MFCD00014961 |
| SMILES | CC1=CC=CC=C1NC(=O)C |
| Synonym | o-acetotoluidide,2'-methylacetanilide,n-o-tolyl acetamide,n-2-methylphenyl acetamide,acetyl-o-toluidine,n-acetyl-o-toluidine,o-acetotoluide,acetamide, n-2-methylphenyl,o-methylacetanilide,n-o-tolylacetamide |
| IUPAC Name | N-(2-methylphenyl)acetamide |
| InChI Key | BPEXTIMJLDWDTL-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |