Benzene and substituted derivatives
Filtered Search Results
Methyl 2-hydroxy-3-nitrobenzoate, 98%
CAS: 22621-41-6 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00272263 InChI Key: NIBVYEHAFBEVFI-UHFFFAOYSA-N Synonym: methyl 2-hydroxy-3-nitrobenzoate,methyl 3-nitrosalicylate,benzoic acid, 2-hydroxy-3-nitro-, methyl ester,2-hydroxy-3-nitrobenzoic acid methyl ester,2-hydroxy-3-nitro-benzoic acid methyl ester,salicylic acid, 3-nitro-, methyl ester,methyl-3-nitrosalicylat,methyl-m-nitrosalicylate,acmc-209fxo,ksc490c4l PubChem CID: 596904 SMILES: COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])O
| PubChem CID | 596904 |
|---|---|
| CAS | 22621-41-6 |
| Molecular Weight (g/mol) | 197.146 |
| MDL Number | MFCD00272263 |
| SMILES | COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])O |
| Synonym | methyl 2-hydroxy-3-nitrobenzoate,methyl 3-nitrosalicylate,benzoic acid, 2-hydroxy-3-nitro-, methyl ester,2-hydroxy-3-nitrobenzoic acid methyl ester,2-hydroxy-3-nitro-benzoic acid methyl ester,salicylic acid, 3-nitro-, methyl ester,methyl-3-nitrosalicylat,methyl-m-nitrosalicylate,acmc-209fxo,ksc490c4l |
| InChI Key | NIBVYEHAFBEVFI-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
2,4,6-Trifluorobenzoic acid, 98%
CAS: 28314-80-9 Molecular Formula: C7H3F3O2 Molecular Weight (g/mol): 176.094 MDL Number: MFCD00042398 InChI Key: SJZATRRXUILGHH-UHFFFAOYSA-N Synonym: benzoic acid, 2,4,6-trifluoro,2,4,6-trifluorobenzoicacid,the derivatives,2,4,6-trifluorobenzioc acid,pubchem1347,acmc-209h1r,ksc204g9t,2,4,6-trifluoro-benzoic acid,rarechem al bo 0448,benzoicacid, 2,4,6-trifluoro PubChem CID: 520373 IUPAC Name: 2,4,6-trifluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)F
| PubChem CID | 520373 |
|---|---|
| CAS | 28314-80-9 |
| Molecular Weight (g/mol) | 176.094 |
| MDL Number | MFCD00042398 |
| SMILES | C1=C(C=C(C(=C1F)C(=O)O)F)F |
| Synonym | benzoic acid, 2,4,6-trifluoro,2,4,6-trifluorobenzoicacid,the derivatives,2,4,6-trifluorobenzioc acid,pubchem1347,acmc-209h1r,ksc204g9t,2,4,6-trifluoro-benzoic acid,rarechem al bo 0448,benzoicacid, 2,4,6-trifluoro |
| IUPAC Name | 2,4,6-trifluorobenzoic acid |
| InChI Key | SJZATRRXUILGHH-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3O2 |
4-Bromo-2-ethyl-1-iodobenzene, 97%, stab. with copper, Thermo Scientific Chemicals
CAS: 175278-30-5 Molecular Formula: C8H8BrI Molecular Weight (g/mol): 310.96 MDL Number: MFCD00221458 InChI Key: JWKQXPHYKRQLEJ-UHFFFAOYSA-N PubChem CID: 2761396 IUPAC Name: 4-bromo-2-ethyl-1-iodobenzene SMILES: CCC1=C(C=CC(=C1)Br)I
| PubChem CID | 2761396 |
|---|---|
| CAS | 175278-30-5 |
| Molecular Weight (g/mol) | 310.96 |
| MDL Number | MFCD00221458 |
| SMILES | CCC1=C(C=CC(=C1)Br)I |
| IUPAC Name | 4-bromo-2-ethyl-1-iodobenzene |
| InChI Key | JWKQXPHYKRQLEJ-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrI |
4-Bromobenzenesulfonamide, 98%
CAS: 701-34-8 Molecular Formula: C6H6BrNO2S Molecular Weight (g/mol): 236.083 MDL Number: MFCD00051977 InChI Key: STYQHICBPYRHQK-UHFFFAOYSA-N Synonym: p-bromobenzenesulfonamide,benzenesulfonamide, p-bromo,benzenesulfonamide, 4-bromo,4-bromobenzene-1-sulfonamide,4-bromo-benzenesulfonamide,4-bromobenzene sulfonamide,pbsa,4-bromophenylsulfonamide,4-bromo-phenylsulfonamide,wln: zswr de PubChem CID: 69696 IUPAC Name: 4-bromobenzenesulfonamide SMILES: C1=CC(=CC=C1S(=O)(=O)N)Br
| PubChem CID | 69696 |
|---|---|
| CAS | 701-34-8 |
| Molecular Weight (g/mol) | 236.083 |
| MDL Number | MFCD00051977 |
| SMILES | C1=CC(=CC=C1S(=O)(=O)N)Br |
| Synonym | p-bromobenzenesulfonamide,benzenesulfonamide, p-bromo,benzenesulfonamide, 4-bromo,4-bromobenzene-1-sulfonamide,4-bromo-benzenesulfonamide,4-bromobenzene sulfonamide,pbsa,4-bromophenylsulfonamide,4-bromo-phenylsulfonamide,wln: zswr de |
| IUPAC Name | 4-bromobenzenesulfonamide |
| InChI Key | STYQHICBPYRHQK-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrNO2S |
1-Benzyl-3-pyrroline, 98%
CAS: 6913-92-4 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.232 MDL Number: MFCD00012324 InChI Key: LRFHKHHUKGZIGE-UHFFFAOYSA-N Synonym: 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline PubChem CID: 561506 IUPAC Name: 1-benzyl-2,5-dihydropyrrole SMILES: C1C=CCN1CC2=CC=CC=C2
| PubChem CID | 561506 |
|---|---|
| CAS | 6913-92-4 |
| Molecular Weight (g/mol) | 159.232 |
| MDL Number | MFCD00012324 |
| SMILES | C1C=CCN1CC2=CC=CC=C2 |
| Synonym | 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline |
| IUPAC Name | 1-benzyl-2,5-dihydropyrrole |
| InChI Key | LRFHKHHUKGZIGE-UHFFFAOYSA-N |
| Molecular Formula | C11H13N |
3-(Trifluoromethyl)phenyltrimethylammonium hydroxide, 5% w/v in methanol
CAS: 68254-41-1 Molecular Formula: C10H14F3NO Molecular Weight (g/mol): 221.223 MDL Number: MFCD00059473 InChI Key: BFPOZPZYPNVMHU-UHFFFAOYSA-M Synonym: 3-trifluoromethyl phenyltrimethylammonium hydroxide,m-tfptah,trifluoromethylphenyltrimethylammoniumhydroxide,3-trifluoromethyl phenyltrimethylammonium hydroxide in methanol,n,n,n-trimethyl-3-trifluoromethyl anilinium hydroxide,trimethyl-3-trifluoromethyl phenyl azanium hydroxide,m-trifluoromethylphenyl trimethylammonium hydroxide,trimethyl-3-trifluoromethylphenylammonium hydroxide,n,n,n-trimethyl-3-trifluoromethyl anilinium oxidanide,trimethyl-alpha,alpha,alpha-trifluoro-m-tolylammonium hydroxide PubChem CID: 2760772 IUPAC Name: trimethyl-[3-(trifluoromethyl)phenyl]azanium;hydroxide SMILES: C[N+](C)(C)C1=CC=CC(=C1)C(F)(F)F.[OH-]
| PubChem CID | 2760772 |
|---|---|
| CAS | 68254-41-1 |
| Molecular Weight (g/mol) | 221.223 |
| MDL Number | MFCD00059473 |
| SMILES | C[N+](C)(C)C1=CC=CC(=C1)C(F)(F)F.[OH-] |
| Synonym | 3-trifluoromethyl phenyltrimethylammonium hydroxide,m-tfptah,trifluoromethylphenyltrimethylammoniumhydroxide,3-trifluoromethyl phenyltrimethylammonium hydroxide in methanol,n,n,n-trimethyl-3-trifluoromethyl anilinium hydroxide,trimethyl-3-trifluoromethyl phenyl azanium hydroxide,m-trifluoromethylphenyl trimethylammonium hydroxide,trimethyl-3-trifluoromethylphenylammonium hydroxide,n,n,n-trimethyl-3-trifluoromethyl anilinium oxidanide,trimethyl-alpha,alpha,alpha-trifluoro-m-tolylammonium hydroxide |
| IUPAC Name | trimethyl-[3-(trifluoromethyl)phenyl]azanium;hydroxide |
| InChI Key | BFPOZPZYPNVMHU-UHFFFAOYSA-M |
| Molecular Formula | C10H14F3NO |
1-Bromo-3-iodobenzene, 98+%
CAS: 591-18-4 Molecular Formula: C6H4BrI Molecular Weight (g/mol): 282.91 MDL Number: MFCD00001043 InChI Key: CTPUUDQIXKUAMO-UHFFFAOYSA-N Synonym: 3-bromoiodobenzene,benzene, 1-bromo-3-iodo,m-bromoiodobenzene,1-bromo-3-iodo-benzene,3-bromo-1-iodobenzene,attercop-chm at127411,m-bromjodbenzol,3-iodobromobenzene,3-bromo iodobenzene PubChem CID: 11561 IUPAC Name: 1-bromo-3-iodobenzene SMILES: BrC1=CC=CC(I)=C1
| PubChem CID | 11561 |
|---|---|
| CAS | 591-18-4 |
| Molecular Weight (g/mol) | 282.91 |
| MDL Number | MFCD00001043 |
| SMILES | BrC1=CC=CC(I)=C1 |
| Synonym | 3-bromoiodobenzene,benzene, 1-bromo-3-iodo,m-bromoiodobenzene,1-bromo-3-iodo-benzene,3-bromo-1-iodobenzene,attercop-chm at127411,m-bromjodbenzol,3-iodobromobenzene,3-bromo iodobenzene |
| IUPAC Name | 1-bromo-3-iodobenzene |
| InChI Key | CTPUUDQIXKUAMO-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrI |
3-Phenoxybenzoyl chloride, ≥97%, Thermo Scientific™
CAS: 3586-15-0 Molecular Formula: C13H9ClO2 Molecular Weight (g/mol): 232.663 MDL Number: MFCD03424712 InChI Key: TTZXIWBOKOZOPL-UHFFFAOYSA-N Synonym: benzoyl chloride, 3-phenoxy,m-phenoxybenzoyl chloride,m-phenoxy benzoylchoride,3-phenoxy benzoyl chloride,3-phenoxy-benzoyl chloride,benzoyl chloride,3-phenoxy PubChem CID: 2760341 IUPAC Name: 3-phenoxybenzoyl chloride SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)Cl
| PubChem CID | 2760341 |
|---|---|
| CAS | 3586-15-0 |
| Molecular Weight (g/mol) | 232.663 |
| MDL Number | MFCD03424712 |
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)Cl |
| Synonym | benzoyl chloride, 3-phenoxy,m-phenoxybenzoyl chloride,m-phenoxy benzoylchoride,3-phenoxy benzoyl chloride,3-phenoxy-benzoyl chloride,benzoyl chloride,3-phenoxy |
| IUPAC Name | 3-phenoxybenzoyl chloride |
| InChI Key | TTZXIWBOKOZOPL-UHFFFAOYSA-N |
| Molecular Formula | C13H9ClO2 |
1,1,4,4-Tetraphenyl-1,3-butadiene, 99%
CAS: 1450-63-1 Molecular Formula: C28H22 Molecular Weight (g/mol): 358.48 MDL Number: MFCD00004766 InChI Key: KLCLIOISYBHYDZ-UHFFFAOYSA-N Synonym: 1,1,4,4-tetraphenyl-1,3-butadiene,tetraphenylbutadiene,1,1,4,4-tetraphenylbutadiene,1,1,4,4-tetraphenylbuta-1,3-diene,1,3-butadiene, 1,1,4,4-tetraphenyl,benzene, 1,1',1,1'-1,3-butadiene-1,4-diylidene tetrakis,tetraphenyl butadiene,1,1',1,1'-1,3-butadiene-1,4-diylidene tetrabenzene,1,4,4-triphenyl-1,3-butadienyl benzene,1,4,4-tetraphenylbutadiene PubChem CID: 74060 IUPAC Name: 1,4,4-triphenylbuta-1,3-dienylbenzene SMILES: C(C=C(C1=CC=CC=C1)C1=CC=CC=C1)=C(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 74060 |
|---|---|
| CAS | 1450-63-1 |
| Molecular Weight (g/mol) | 358.48 |
| MDL Number | MFCD00004766 |
| SMILES | C(C=C(C1=CC=CC=C1)C1=CC=CC=C1)=C(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,1,4,4-tetraphenyl-1,3-butadiene,tetraphenylbutadiene,1,1,4,4-tetraphenylbutadiene,1,1,4,4-tetraphenylbuta-1,3-diene,1,3-butadiene, 1,1,4,4-tetraphenyl,benzene, 1,1',1,1'-1,3-butadiene-1,4-diylidene tetrakis,tetraphenyl butadiene,1,1',1,1'-1,3-butadiene-1,4-diylidene tetrabenzene,1,4,4-triphenyl-1,3-butadienyl benzene,1,4,4-tetraphenylbutadiene |
| IUPAC Name | 1,4,4-triphenylbuta-1,3-dienylbenzene |
| InChI Key | KLCLIOISYBHYDZ-UHFFFAOYSA-N |
| Molecular Formula | C28H22 |
(R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 99+%
CAS: 76189-55-4 Molecular Formula: C44H32P2 Molecular Weight (g/mol): 622.69 MDL Number: MFCD00010805 InChI Key: MUALRAIOVNYAIW-UHFFFAOYSA-N Synonym: binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene PubChem CID: 634876 SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 634876 |
|---|---|
| CAS | 76189-55-4 |
| Molecular Weight (g/mol) | 622.69 |
| MDL Number | MFCD00010805 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene |
| InChI Key | MUALRAIOVNYAIW-UHFFFAOYSA-N |
| Molecular Formula | C44H32P2 |
alpha,alpha-Dimethylbenzylamine, 96%
CAS: 585-32-0 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00134680 InChI Key: KDFDOINBXBEOLZ-UHFFFAOYSA-N Synonym: cumylamine,alpha,alpha-dimethylbenzylamine,1-methyl-1-phenyl-ethylamine,1-methyl-1-phenylethylamine,2-phenyl-2-propanamine,alpha-aminoisopropylbenzene,benzenemethanamine, alpha,alpha-dimethyl,dimethyl-aminophenylmethane,cumyl amine,phenisopropyl amine PubChem CID: 68509 IUPAC Name: 2-phenylpropan-2-amine SMILES: CC(C)(N)C1=CC=CC=C1
| PubChem CID | 68509 |
|---|---|
| CAS | 585-32-0 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00134680 |
| SMILES | CC(C)(N)C1=CC=CC=C1 |
| Synonym | cumylamine,alpha,alpha-dimethylbenzylamine,1-methyl-1-phenyl-ethylamine,1-methyl-1-phenylethylamine,2-phenyl-2-propanamine,alpha-aminoisopropylbenzene,benzenemethanamine, alpha,alpha-dimethyl,dimethyl-aminophenylmethane,cumyl amine,phenisopropyl amine |
| IUPAC Name | 2-phenylpropan-2-amine |
| InChI Key | KDFDOINBXBEOLZ-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
4-Benzyloxybenzyl alcohol, 98+%
CAS: 836-43-1 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00004654 InChI Key: OEBIVOHKFYSBPE-UHFFFAOYSA-N Synonym: 4-benzyloxybenzyl alcohol,4-benzyloxy phenyl methanol,p-benzyloxybenzyl alcohol,4-benzyloxybenzylalcohol,4-benzyloxy benzyl alcohol,benzenemethanol, 4-phenylmethoxy,p-alkoxybenzyl alcohol resin,4-phenylmethoxyphenyl methanol,argopore-wang PubChem CID: 70043 ChEBI: CHEBI:29486 IUPAC Name: (4-phenylmethoxyphenyl)methanol SMILES: OCC1=CC=C(OCC2=CC=CC=C2)C=C1
| PubChem CID | 70043 |
|---|---|
| CAS | 836-43-1 |
| Molecular Weight (g/mol) | 214.26 |
| ChEBI | CHEBI:29486 |
| MDL Number | MFCD00004654 |
| SMILES | OCC1=CC=C(OCC2=CC=CC=C2)C=C1 |
| Synonym | 4-benzyloxybenzyl alcohol,4-benzyloxy phenyl methanol,p-benzyloxybenzyl alcohol,4-benzyloxybenzylalcohol,4-benzyloxy benzyl alcohol,benzenemethanol, 4-phenylmethoxy,p-alkoxybenzyl alcohol resin,4-phenylmethoxyphenyl methanol,argopore-wang |
| IUPAC Name | (4-phenylmethoxyphenyl)methanol |
| InChI Key | OEBIVOHKFYSBPE-UHFFFAOYSA-N |
| Molecular Formula | C14H14O2 |
4-(Bromomethyl)phenylboronic acid, 97%
CAS: 68162-47-0 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318113 InChI Key: PDNOURKEZJZJNZ-UHFFFAOYSA-N Synonym: 4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl PubChem CID: 2735593 IUPAC Name: [4-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=C(CBr)C=C1
| PubChem CID | 2735593 |
|---|---|
| CAS | 68162-47-0 |
| Molecular Weight (g/mol) | 214.85 |
| MDL Number | MFCD01318113 |
| SMILES | OB(O)C1=CC=C(CBr)C=C1 |
| Synonym | 4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl |
| IUPAC Name | [4-(bromomethyl)phenyl]boronic acid |
| InChI Key | PDNOURKEZJZJNZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8BBrO2 |
4-(Morpholine-4-sulfonyl)-benzenesulfonyl chloride, Technical Grade, Thermo Scientific™
CAS: 465514-13-0 Molecular Formula: C10H12ClNO5S2 Molecular Weight (g/mol): 325.778 InChI Key: ZZSBUDUHESWZJB-UHFFFAOYSA-N Synonym: 4-morpholin-4-ylsulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl benzene-1-sulfonyl chloride,4-morpholinosulfonyl benzene-1-sulfonyl chloride,4-morpholine-4-sulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonyl chloride,4-morpholine-4-sulfonyl phenylsulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonylchloride PubChem CID: 2779790 IUPAC Name: 4-morpholin-4-ylsulfonylbenzenesulfonyl chloride SMILES: C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)Cl
| PubChem CID | 2779790 |
|---|---|
| CAS | 465514-13-0 |
| Molecular Weight (g/mol) | 325.778 |
| SMILES | C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)Cl |
| Synonym | 4-morpholin-4-ylsulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl benzene-1-sulfonyl chloride,4-morpholinosulfonyl benzene-1-sulfonyl chloride,4-morpholine-4-sulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonyl chloride,4-morpholine-4-sulfonyl phenylsulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonylchloride |
| IUPAC Name | 4-morpholin-4-ylsulfonylbenzenesulfonyl chloride |
| InChI Key | ZZSBUDUHESWZJB-UHFFFAOYSA-N |
| Molecular Formula | C10H12ClNO5S2 |