Benzene and substituted derivatives
Filtered Search Results
4-Chloro-3-nitrotoluene, 97+%
CAS: 89-60-1 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007085 InChI Key: NWESJZZPAJGHRZ-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrotoluene,3-nitro-4-chlorotoluene,benzene, 1-chloro-4-methyl-2-nitro,2-chloro-5-methylnitrobenzene,1-chloro-4-methyl-2-nitro-benzene,toluene, 4-chloro-3-nitro,3-nitro-4-chlorotoluol,pubchem19752,4,3-chloronitrotoluene,4-chloro-3-nitro-toluene PubChem CID: 6976 IUPAC Name: 1-chloro-4-methyl-2-nitrobenzene SMILES: CC1=CC=C(Cl)C(=C1)[N+]([O-])=O
| PubChem CID | 6976 |
|---|---|
| CAS | 89-60-1 |
| Molecular Weight (g/mol) | 171.58 |
| MDL Number | MFCD00007085 |
| SMILES | CC1=CC=C(Cl)C(=C1)[N+]([O-])=O |
| Synonym | 4-chloro-3-nitrotoluene,3-nitro-4-chlorotoluene,benzene, 1-chloro-4-methyl-2-nitro,2-chloro-5-methylnitrobenzene,1-chloro-4-methyl-2-nitro-benzene,toluene, 4-chloro-3-nitro,3-nitro-4-chlorotoluol,pubchem19752,4,3-chloronitrotoluene,4-chloro-3-nitro-toluene |
| IUPAC Name | 1-chloro-4-methyl-2-nitrobenzene |
| InChI Key | NWESJZZPAJGHRZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO2 |
4-Fluoro-2-methylaniline, 97%
CAS: 452-71-1 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007832 InChI Key: KMHLGVTVACLEJE-UHFFFAOYSA-N Synonym: 2-amino-5-fluorotoluene,benzenamine, 4-fluoro-2-methyl,4-fluoro-2-methylbenzenamine,6-amino-3-fluorotoluene,o-toluidine, 4-fluoro,2-methyl-4-fluoroaniline,4-fluorotoluidine,4-fluoro-o-toluidine,3-fluoro-6-aminotoluene PubChem CID: 67982 IUPAC Name: 4-fluoro-2-methylaniline SMILES: CC1=CC(F)=CC=C1N
| PubChem CID | 67982 |
|---|---|
| CAS | 452-71-1 |
| Molecular Weight (g/mol) | 125.15 |
| MDL Number | MFCD00007832 |
| SMILES | CC1=CC(F)=CC=C1N |
| Synonym | 2-amino-5-fluorotoluene,benzenamine, 4-fluoro-2-methyl,4-fluoro-2-methylbenzenamine,6-amino-3-fluorotoluene,o-toluidine, 4-fluoro,2-methyl-4-fluoroaniline,4-fluorotoluidine,4-fluoro-o-toluidine,3-fluoro-6-aminotoluene |
| IUPAC Name | 4-fluoro-2-methylaniline |
| InChI Key | KMHLGVTVACLEJE-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |
3-Iodobenzotrifluoride, 98+%
CAS: 401-81-0 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.009 MDL Number: MFCD00001049 InChI Key: IGISPMBUGPHLBY-UHFFFAOYSA-N Synonym: 1-iodo-3-trifluoromethyl benzene,3-iodobenzotrifluoride,m-iodobenzotrifluoride,benzene, 1-iodo-3-trifluoromethyl,3-iodobenztrifluoride,m-trifluoromethyl iodobenzene,3-iodo-alpha,alpha,alpha-trifluorotoluene,3-trifluoromethyliodobenzene,3-trifluoromethyl-iodobenzene,alpha,alpha,alpha-trifluoro-m-iodotoluene PubChem CID: 67868 IUPAC Name: 1-iodo-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)I)C(F)(F)F
| PubChem CID | 67868 |
|---|---|
| CAS | 401-81-0 |
| Molecular Weight (g/mol) | 272.009 |
| MDL Number | MFCD00001049 |
| SMILES | C1=CC(=CC(=C1)I)C(F)(F)F |
| Synonym | 1-iodo-3-trifluoromethyl benzene,3-iodobenzotrifluoride,m-iodobenzotrifluoride,benzene, 1-iodo-3-trifluoromethyl,3-iodobenztrifluoride,m-trifluoromethyl iodobenzene,3-iodo-alpha,alpha,alpha-trifluorotoluene,3-trifluoromethyliodobenzene,3-trifluoromethyl-iodobenzene,alpha,alpha,alpha-trifluoro-m-iodotoluene |
| IUPAC Name | 1-iodo-3-(trifluoromethyl)benzene |
| InChI Key | IGISPMBUGPHLBY-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3I |
(+/-)-Miconazole nitrate, 98+%
CAS: 22832-87-7 Molecular Formula: C18H15Cl4N3O4 Molecular Weight (g/mol): 479.14 MDL Number: MFCD00058161 InChI Key: MCCACAIVAXEFAL-UHFFFAOYNA-N Synonym: miconazole nitrate,albistat,andergin,aflorix,conofite,florid,micatin,gyno-monistat,epi-monistat,gyno-daktar PubChem CID: 68553 IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole; nitric acid SMILES: O[N+]([O-])=O.ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1
| PubChem CID | 68553 |
|---|---|
| CAS | 22832-87-7 |
| Molecular Weight (g/mol) | 479.14 |
| MDL Number | MFCD00058161 |
| SMILES | O[N+]([O-])=O.ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1 |
| Synonym | miconazole nitrate,albistat,andergin,aflorix,conofite,florid,micatin,gyno-monistat,epi-monistat,gyno-daktar |
| IUPAC Name | 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole; nitric acid |
| InChI Key | MCCACAIVAXEFAL-UHFFFAOYNA-N |
| Molecular Formula | C18H15Cl4N3O4 |
Ambroxol hydrochloride, 98%
CAS: 23828-92-4 Molecular Formula: C13H18Br2N2O Molecular Weight (g/mol): 378.108 MDL Number: MFCD00078932 InChI Key: JBDGDEWWOUBZPM-UHFFFAOYSA-N Synonym: ambroxol,ambroxolum,bisolvon metabolite viii,bromhexine-metabolite viii,4-2-amino-3,5-dibromobenzyl amino cyclohexanol,ambroxol inn:ban,ambroxol ep impurity d,ambroxol base,ambroxolum inn-latin,rac-cis-ambroxol PubChem CID: 2132 IUPAC Name: 4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol SMILES: C1CC(CCC1NCC2=CC(=CC(=C2N)Br)Br)O
| PubChem CID | 2132 |
|---|---|
| CAS | 23828-92-4 |
| Molecular Weight (g/mol) | 378.108 |
| MDL Number | MFCD00078932 |
| SMILES | C1CC(CCC1NCC2=CC(=CC(=C2N)Br)Br)O |
| Synonym | ambroxol,ambroxolum,bisolvon metabolite viii,bromhexine-metabolite viii,4-2-amino-3,5-dibromobenzyl amino cyclohexanol,ambroxol inn:ban,ambroxol ep impurity d,ambroxol base,ambroxolum inn-latin,rac-cis-ambroxol |
| IUPAC Name | 4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol |
| InChI Key | JBDGDEWWOUBZPM-UHFFFAOYSA-N |
| Molecular Formula | C13H18Br2N2O |
4-Aminophthalic acid, 98%
CAS: 5434-21-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00013985 InChI Key: OXSANYRLJHSQEP-UHFFFAOYSA-N Synonym: 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 PubChem CID: 72912 IUPAC Name: 4-aminophthalic acid SMILES: C1=CC(=C(C=C1N)C(=O)O)C(=O)O
| PubChem CID | 72912 |
|---|---|
| CAS | 5434-21-9 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00013985 |
| SMILES | C1=CC(=C(C=C1N)C(=O)O)C(=O)O |
| Synonym | 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 |
| IUPAC Name | 4-aminophthalic acid |
| InChI Key | OXSANYRLJHSQEP-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Methyl hydrogen isophthalate, 97%
CAS: 1877-71-0 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00029972 InChI Key: WMZNGTSLFSJHMZ-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl benzoic acid,mono-methyl isophthalate,methyl hydrogen isophthalate,isophthalic acid monomethyl ester,monomethyl isophthalate,isophthalic acid methyl ester,isophthalic acid, methyl ester,isophthalic acid, monomethyl ester,methyl m-phthalate,methyl 3-carboxybenzoate PubChem CID: 601880 IUPAC Name: 3-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=CC(=C1)C(=O)O
| PubChem CID | 601880 |
|---|---|
| CAS | 1877-71-0 |
| Molecular Weight (g/mol) | 180.159 |
| MDL Number | MFCD00029972 |
| SMILES | COC(=O)C1=CC=CC(=C1)C(=O)O |
| Synonym | 3-methoxycarbonyl benzoic acid,mono-methyl isophthalate,methyl hydrogen isophthalate,isophthalic acid monomethyl ester,monomethyl isophthalate,isophthalic acid methyl ester,isophthalic acid, methyl ester,isophthalic acid, monomethyl ester,methyl m-phthalate,methyl 3-carboxybenzoate |
| IUPAC Name | 3-methoxycarbonylbenzoic acid |
| InChI Key | WMZNGTSLFSJHMZ-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
5-Cyano-2-methoxybenzaldehyde, 97%
CAS: 21962-53-8 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD13195275 InChI Key: HJDXZGCTGAWUFZ-UHFFFAOYSA-N Synonym: 5-cyano-2-methoxybenzaldehyde,3-formyl-4-methoxy-benzonitrile,3-cyano6-methoxybenzaldehyde,5-cyano-2-methoxy benzaldehyde PubChem CID: 10241098 IUPAC Name: 3-formyl-4-methoxybenzonitrile SMILES: COC1=C(C=C(C=C1)C#N)C=O
| PubChem CID | 10241098 |
|---|---|
| CAS | 21962-53-8 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD13195275 |
| SMILES | COC1=C(C=C(C=C1)C#N)C=O |
| Synonym | 5-cyano-2-methoxybenzaldehyde,3-formyl-4-methoxy-benzonitrile,3-cyano6-methoxybenzaldehyde,5-cyano-2-methoxy benzaldehyde |
| IUPAC Name | 3-formyl-4-methoxybenzonitrile |
| InChI Key | HJDXZGCTGAWUFZ-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
6-Fluoro-2,3-dimethoxybenzoic acid, 95%
CAS: 265670-72-2 Molecular Formula: C9H9FO4 Molecular Weight (g/mol): 200.165 MDL Number: MFCD13193706 InChI Key: OXYSHPNWRGUQPS-UHFFFAOYSA-N Synonym: benzoic acid, 6-fluoro-2,3-dimethoxy,5,6-dimethoxy-2-fluorobenzoic acid,6-fluoro-2,3-dimethoxybenzoicacid,2,3-dimethoxy-6-fluorobenzoic acid,#,benzoicacid, 6-fluoro-2,3-dimethoxy,benzoic acid, 2-fluoro-5,6-dimethoxy PubChem CID: 608235 IUPAC Name: 6-fluoro-2,3-dimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)F)C(=O)O)OC
| PubChem CID | 608235 |
|---|---|
| CAS | 265670-72-2 |
| Molecular Weight (g/mol) | 200.165 |
| MDL Number | MFCD13193706 |
| SMILES | COC1=C(C(=C(C=C1)F)C(=O)O)OC |
| Synonym | benzoic acid, 6-fluoro-2,3-dimethoxy,5,6-dimethoxy-2-fluorobenzoic acid,6-fluoro-2,3-dimethoxybenzoicacid,2,3-dimethoxy-6-fluorobenzoic acid,#,benzoicacid, 6-fluoro-2,3-dimethoxy,benzoic acid, 2-fluoro-5,6-dimethoxy |
| IUPAC Name | 6-fluoro-2,3-dimethoxybenzoic acid |
| InChI Key | OXYSHPNWRGUQPS-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO4 |
4-Fluoro-2-nitro-5-(trifluoromethyl)aniline, 98%
CAS: 179062-05-6 Molecular Formula: C7H4F4N2O2 Molecular Weight (g/mol): 224.115 MDL Number: MFCD03094267 InChI Key: WOSGMZUIHAFPSS-UHFFFAOYSA-N Synonym: 5-amino-2-fluoro-4-nitrobenzotrifluoride,4-fluoro-2-nitro-5-trifluoromethyl aniline,benzenamine, 4-fluoro-2-nitro-5-trifluoromethyl,pubchem4933,ksc106o9t,2-fluoro-4-nitro-5-aminobenzotrifluoride,3-amino-6-fluoro-4-nitrobenzotrifluoride,4-fluoro-2-nitro-5-trifluoromethyl benzenamine,4-fluoro-2-nitro-5-trifluoromethyl phenylamine PubChem CID: 2737686 IUPAC Name: 4-fluoro-2-nitro-5-(trifluoromethyl)aniline SMILES: C1=C(C(=CC(=C1N)[N+](=O)[O-])F)C(F)(F)F
| PubChem CID | 2737686 |
|---|---|
| CAS | 179062-05-6 |
| Molecular Weight (g/mol) | 224.115 |
| MDL Number | MFCD03094267 |
| SMILES | C1=C(C(=CC(=C1N)[N+](=O)[O-])F)C(F)(F)F |
| Synonym | 5-amino-2-fluoro-4-nitrobenzotrifluoride,4-fluoro-2-nitro-5-trifluoromethyl aniline,benzenamine, 4-fluoro-2-nitro-5-trifluoromethyl,pubchem4933,ksc106o9t,2-fluoro-4-nitro-5-aminobenzotrifluoride,3-amino-6-fluoro-4-nitrobenzotrifluoride,4-fluoro-2-nitro-5-trifluoromethyl benzenamine,4-fluoro-2-nitro-5-trifluoromethyl phenylamine |
| IUPAC Name | 4-fluoro-2-nitro-5-(trifluoromethyl)aniline |
| InChI Key | WOSGMZUIHAFPSS-UHFFFAOYSA-N |
| Molecular Formula | C7H4F4N2O2 |
Ribonucleic acid from Baker's yeast
CAS: 63231-63-0 MDL Number: MFCD00132196 IUPAC Name: Ribonucleic acid
| CAS | 63231-63-0 |
|---|---|
| MDL Number | MFCD00132196 |
| IUPAC Name | Ribonucleic acid |
4-(Bromomethyl)benzenesulfonyl chloride, 95%
CAS: 66176-39-4 Molecular Formula: C7H6BrClO2S Molecular Weight (g/mol): 269.537 MDL Number: MFCD00156129 InChI Key: QXTQWYZHHMQSQH-UHFFFAOYSA-N Synonym: 4-bromomethyl benzenesulfonyl chloride,4-bromomethyl benzene-1-sulfonyl chloride,4-bromomethyl benzenesulfonylchloride,alpha-bromo-p-toluenesulphonyl chloride,alpha-bromo-p-toluenesulfonyl chloride,4-bromomethyl benzenesulphonyl chloride,4-bromomethyl benzene-1-sulfonylchloride,buttpark 94\04-08,4-bromomethyl phenyl chlorosulfone,4-bromomethylene benzenesulfonyl chloride PubChem CID: 2734409 IUPAC Name: 4-(bromomethyl)benzenesulfonyl chloride SMILES: C1=CC(=CC=C1CBr)S(=O)(=O)Cl
| PubChem CID | 2734409 |
|---|---|
| CAS | 66176-39-4 |
| Molecular Weight (g/mol) | 269.537 |
| MDL Number | MFCD00156129 |
| SMILES | C1=CC(=CC=C1CBr)S(=O)(=O)Cl |
| Synonym | 4-bromomethyl benzenesulfonyl chloride,4-bromomethyl benzene-1-sulfonyl chloride,4-bromomethyl benzenesulfonylchloride,alpha-bromo-p-toluenesulphonyl chloride,alpha-bromo-p-toluenesulfonyl chloride,4-bromomethyl benzenesulphonyl chloride,4-bromomethyl benzene-1-sulfonylchloride,buttpark 94\04-08,4-bromomethyl phenyl chlorosulfone,4-bromomethylene benzenesulfonyl chloride |
| IUPAC Name | 4-(bromomethyl)benzenesulfonyl chloride |
| InChI Key | QXTQWYZHHMQSQH-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO2S |
3-Methyl-4-nitrobenzonitrile, 97%
CAS: 96784-54-2 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00017615 InChI Key: IHVNKSXTJZNBQA-UHFFFAOYSA-N Synonym: benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa PubChem CID: 2801434 IUPAC Name: 3-methyl-4-nitrobenzonitrile SMILES: CC1=C(C=CC(=C1)C#N)[N+](=O)[O-]
| PubChem CID | 2801434 |
|---|---|
| CAS | 96784-54-2 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00017615 |
| SMILES | CC1=C(C=CC(=C1)C#N)[N+](=O)[O-] |
| Synonym | benzonitrile, 3-methyl-4-nitro,5-cyano-2-nitrotoluene,3-methyl-4-nitro-benzonitrile,3-methyl-4-nitrobenzenecarbonitrile,4-nitro-m-tolunitrile,4-cyano-2-methylnitrobenzene,ihvnksxtjznbqa-uhfffaoysa |
| IUPAC Name | 3-methyl-4-nitrobenzonitrile |
| InChI Key | IHVNKSXTJZNBQA-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
Anisole, ReagentPlus™, 99%, Solstice
CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00008354 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
| PubChem CID | 7519 |
|---|---|
| CAS | 100-66-3 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:16579 |
| MDL Number | MFCD00008354 |
| SMILES | COC1=CC=CC=C1 |
| Synonym | methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene |
| IUPAC Name | anisole |
| InChI Key | RDOXTESZEPMUJZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
| CAS | 2751-90-8 |
|---|