Benzene and substituted derivatives
Filtered Search Results
Methyl 2-Chloro-4-fluorobenzoate 98.0+%, TCI America™
CAS: 85953-29-3 Molecular Formula: C8H6ClFO2 Molecular Weight (g/mol): 188.582 MDL Number: MFCD00173937 InChI Key: YZDLPZNWBRBZMZ-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate PubChem CID: 2763551 IUPAC Name: methyl 2-chloro-4-fluorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)F)Cl
| PubChem CID | 2763551 |
|---|---|
| CAS | 85953-29-3 |
| Molecular Weight (g/mol) | 188.582 |
| MDL Number | MFCD00173937 |
| SMILES | COC(=O)C1=C(C=C(C=C1)F)Cl |
| Synonym | 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate |
| IUPAC Name | methyl 2-chloro-4-fluorobenzoate |
| InChI Key | YZDLPZNWBRBZMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO2 |
[RuCl(p-cymene)((S)-xylbinap)]Cl, TCI America™
CAS: 944451-25-6 Molecular Formula: C62H62Cl2P2Ru Molecular Weight (g/mol): 1041.096 MDL Number: MFCD09753015 InChI Key: CBZXDZCPCDMKJU-UHFFFAOYSA-L Synonym: Chloro[(S)-(-)-2,2′C-bis[di(3,5-xylyl)phosphino]-1,1′C-binaphthyl](p-cymene)ruthenium(II) Chloride PubChem CID: 72376324 IUPAC Name: [1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;dichlororuthenium;1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C.CC1=CC(=CC(=C1)P(C2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(C6=CC(=CC(=C6)C)C)C7=CC(=CC(=C7)C)C)C8=CC(=CC(=C8)C)C)C.Cl[Ru]Cl
| PubChem CID | 72376324 |
|---|---|
| CAS | 944451-25-6 |
| Molecular Weight (g/mol) | 1041.096 |
| MDL Number | MFCD09753015 |
| SMILES | CC1=CC=C(C=C1)C(C)C.CC1=CC(=CC(=C1)P(C2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(C6=CC(=CC(=C6)C)C)C7=CC(=CC(=C7)C)C)C8=CC(=CC(=C8)C)C)C.Cl[Ru]Cl |
| Synonym | Chloro[(S)-(-)-2,2′C-bis[di(3,5-xylyl)phosphino]-1,1′C-binaphthyl](p-cymene)ruthenium(II) Chloride |
| IUPAC Name | [1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;dichlororuthenium;1-methyl-4-propan-2-ylbenzene |
| InChI Key | CBZXDZCPCDMKJU-UHFFFAOYSA-L |
| Molecular Formula | C62H62Cl2P2Ru |
Isopropamide Iodide 95.0+%, TCI America™
CAS: 71-81-8 Molecular Formula: C23H33IN2O Molecular Weight (g/mol): 480.434 MDL Number: MFCD00063513 InChI Key: BFSMWENDZZIWPW-UHFFFAOYSA-N Synonym: 4-Amino-N,N-diisopropyl-N-methyl-4-oxo-3,3-diphenyl-1-butanaminium Iodide, (3-Carbamoyl-3,3-diphenylpropyl)diisopropylmethylammonium Iodide PubChem CID: 6284 IUPAC Name: (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;iodide SMILES: CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.[I-]
| PubChem CID | 6284 |
|---|---|
| CAS | 71-81-8 |
| Molecular Weight (g/mol) | 480.434 |
| MDL Number | MFCD00063513 |
| SMILES | CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.[I-] |
| Synonym | 4-Amino-N,N-diisopropyl-N-methyl-4-oxo-3,3-diphenyl-1-butanaminium Iodide, (3-Carbamoyl-3,3-diphenylpropyl)diisopropylmethylammonium Iodide |
| IUPAC Name | (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;iodide |
| InChI Key | BFSMWENDZZIWPW-UHFFFAOYSA-N |
| Molecular Formula | C23H33IN2O |
Monoethyl 5-Nitroisophthalate 98.0+%, TCI America™
CAS: 22871-55-2 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00130051 InChI Key: HOYHBDFTELAGGG-UHFFFAOYSA-N Synonym: 5-Nitroisophthalic Acid Monoethyl Ester PubChem CID: 89872 IUPAC Name: 3-ethoxycarbonyl-5-nitrobenzoic acid SMILES: CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
| PubChem CID | 89872 |
|---|---|
| CAS | 22871-55-2 |
| Molecular Weight (g/mol) | 239.183 |
| MDL Number | MFCD00130051 |
| SMILES | CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-] |
| Synonym | 5-Nitroisophthalic Acid Monoethyl Ester |
| IUPAC Name | 3-ethoxycarbonyl-5-nitrobenzoic acid |
| InChI Key | HOYHBDFTELAGGG-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO6 |
2-Bromo-5-fluoroanisole 95.0+%, TCI America™
CAS: 450-88-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD04973752 InChI Key: KGYXKRGMSUHYCY-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene PubChem CID: 7018043 IUPAC Name: 1-bromo-4-fluoro-2-methoxybenzene SMILES: COC1=CC(F)=CC=C1Br
| PubChem CID | 7018043 |
|---|---|
| CAS | 450-88-4 |
| Molecular Weight (g/mol) | 205.03 |
| MDL Number | MFCD04973752 |
| SMILES | COC1=CC(F)=CC=C1Br |
| Synonym | 2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene |
| IUPAC Name | 1-bromo-4-fluoro-2-methoxybenzene |
| InChI Key | KGYXKRGMSUHYCY-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrFO |
4-(4-Butylphenylazo)phenol 98.0+%, TCI America™
CAS: 2496-21-1 Molecular Formula: C16H18N2O Molecular Weight (g/mol): 254.333 MDL Number: MFCD00430795 InChI Key: MHSQAHVLQVTXKH-UHFFFAOYSA-N PubChem CID: 5705751 IUPAC Name: 4-[(4-butylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one SMILES: CCCCC1=CC=C(C=C1)NN=C2C=CC(=O)C=C2
| PubChem CID | 5705751 |
|---|---|
| CAS | 2496-21-1 |
| Molecular Weight (g/mol) | 254.333 |
| MDL Number | MFCD00430795 |
| SMILES | CCCCC1=CC=C(C=C1)NN=C2C=CC(=O)C=C2 |
| IUPAC Name | 4-[(4-butylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one |
| InChI Key | MHSQAHVLQVTXKH-UHFFFAOYSA-N |
| Molecular Formula | C16H18N2O |
Ethyl 4-(Trifluoromethyl)benzoate 98.0+%, TCI America™
CAS: 583-02-8 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD00013563 InChI Key: ZQDADDSPMCHZPX-UHFFFAOYSA-N Synonym: ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester PubChem CID: 521827 IUPAC Name: ethyl 4-(trifluoromethyl)benzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 521827 |
|---|---|
| CAS | 583-02-8 |
| Molecular Weight (g/mol) | 218.175 |
| MDL Number | MFCD00013563 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)C(F)(F)F |
| Synonym | ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester |
| IUPAC Name | ethyl 4-(trifluoromethyl)benzoate |
| InChI Key | ZQDADDSPMCHZPX-UHFFFAOYSA-N |
| Molecular Formula | C10H9F3O2 |
Diphenyl Chlorophosphate 95.0+%, TCI America™
CAS: 2524-64-3 Molecular Formula: C12H10ClO3P Molecular Weight (g/mol): 268.633 MDL Number: MFCD00003030 InChI Key: BHIIGRBMZRSDRI-UHFFFAOYSA-N Synonym: diphenyl chlorophosphate,diphenyl phosphorochloridate,diphenylchlorophosphate,phosphorochloridic acid, diphenyl ester,chlorodiphenyl phosphate,o,o-diphenyl chlorophosphate,chlorodiphenoxyphosphine oxide,diphenoxychlorophosphine oxide,diphenyl chlorophosphonate,diphenylphosphoric acid monochloride PubChem CID: 75654 IUPAC Name: [chloro(phenoxy)phosphoryl]oxybenzene SMILES: C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl
| PubChem CID | 75654 |
|---|---|
| CAS | 2524-64-3 |
| Molecular Weight (g/mol) | 268.633 |
| MDL Number | MFCD00003030 |
| SMILES | C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl |
| Synonym | diphenyl chlorophosphate,diphenyl phosphorochloridate,diphenylchlorophosphate,phosphorochloridic acid, diphenyl ester,chlorodiphenyl phosphate,o,o-diphenyl chlorophosphate,chlorodiphenoxyphosphine oxide,diphenoxychlorophosphine oxide,diphenyl chlorophosphonate,diphenylphosphoric acid monochloride |
| IUPAC Name | [chloro(phenoxy)phosphoryl]oxybenzene |
| InChI Key | BHIIGRBMZRSDRI-UHFFFAOYSA-N |
| Molecular Formula | C12H10ClO3P |
1-Bromo-3,4,5-trifluorobenzene 98.0+%, TCI America™
CAS: 138526-69-9 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.981 MDL Number: MFCD00070738 InChI Key: HKJCELUUIFFSIN-UHFFFAOYSA-N Synonym: 1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide PubChem CID: 611409 IUPAC Name: 5-bromo-1,2,3-trifluorobenzene SMILES: C1=C(C=C(C(=C1F)F)F)Br
| PubChem CID | 611409 |
|---|---|
| CAS | 138526-69-9 |
| Molecular Weight (g/mol) | 210.981 |
| MDL Number | MFCD00070738 |
| SMILES | C1=C(C=C(C(=C1F)F)F)Br |
| Synonym | 1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide |
| IUPAC Name | 5-bromo-1,2,3-trifluorobenzene |
| InChI Key | HKJCELUUIFFSIN-UHFFFAOYSA-N |
| Molecular Formula | C6H2BrF3 |
4-tert-Butylaniline 98.0+%, TCI America™
CAS: 769-92-6 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00007899 InChI Key: WRDWWAVNELMWAM-UHFFFAOYSA-N Synonym: 4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine PubChem CID: 69861 IUPAC Name: 4-tert-butylaniline SMILES: CC(C)(C)C1=CC=C(C=C1)N
| PubChem CID | 69861 |
|---|---|
| CAS | 769-92-6 |
| Molecular Weight (g/mol) | 149.237 |
| MDL Number | MFCD00007899 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)N |
| Synonym | 4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine |
| IUPAC Name | 4-tert-butylaniline |
| InChI Key | WRDWWAVNELMWAM-UHFFFAOYSA-N |
| Molecular Formula | C10H15N |
3,4-Difluorobenzotrifluoride 97.0+%, TCI America™
CAS: 32137-19-2 Molecular Formula: C7H3F5 Molecular Weight (g/mol): 182.09 MDL Number: MFCD00077510 InChI Key: MVCGQTYWLZSKSB-UHFFFAOYSA-N Synonym: 3,4-difluorobenzotrifluoride,1,2-difluoro-4-trifluoromethyl benzene,alpha,alpha,alpha,3,4-pentafluorotoluene,benzene, 1,2-difluoro-4-trifluoromethyl,pubchem1651,ksc497k4r,1,2-difluoro-4-trifluoromethyl benzene # PubChem CID: 602797 IUPAC Name: 1,2-difluoro-4-(trifluoromethyl)benzene SMILES: FC1=CC=C(C=C1F)C(F)(F)F
| PubChem CID | 602797 |
|---|---|
| CAS | 32137-19-2 |
| Molecular Weight (g/mol) | 182.09 |
| MDL Number | MFCD00077510 |
| SMILES | FC1=CC=C(C=C1F)C(F)(F)F |
| Synonym | 3,4-difluorobenzotrifluoride,1,2-difluoro-4-trifluoromethyl benzene,alpha,alpha,alpha,3,4-pentafluorotoluene,benzene, 1,2-difluoro-4-trifluoromethyl,pubchem1651,ksc497k4r,1,2-difluoro-4-trifluoromethyl benzene # |
| IUPAC Name | 1,2-difluoro-4-(trifluoromethyl)benzene |
| InChI Key | MVCGQTYWLZSKSB-UHFFFAOYSA-N |
| Molecular Formula | C7H3F5 |
N-(o-Toluoyl)glycine 98.0+%, TCI America™
CAS: 42013-20-7 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 MDL Number: MFCD00050991 InChI Key: YOEBAVRJHRCKRE-UHFFFAOYSA-N Synonym: 2-Methylhippuric Acid, N-(2-Methylbenzoyl)glycine PubChem CID: 91637 ChEBI: CHEBI:68455 IUPAC Name: 2-[(2-methylbenzoyl)amino]acetic acid SMILES: CC1=CC=CC=C1C(=O)NCC(=O)O
| PubChem CID | 91637 |
|---|---|
| CAS | 42013-20-7 |
| Molecular Weight (g/mol) | 193.202 |
| ChEBI | CHEBI:68455 |
| MDL Number | MFCD00050991 |
| SMILES | CC1=CC=CC=C1C(=O)NCC(=O)O |
| Synonym | 2-Methylhippuric Acid, N-(2-Methylbenzoyl)glycine |
| IUPAC Name | 2-[(2-methylbenzoyl)amino]acetic acid |
| InChI Key | YOEBAVRJHRCKRE-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO3 |
1-Bromo-3-chloro-5-fluorobenzene 98.0+%, TCI America™
CAS: 33863-76-2 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.442 MDL Number: MFCD00070747 InChI Key: GGMDFPMASIXEIR-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene PubChem CID: 2736223 IUPAC Name: 1-bromo-3-chloro-5-fluorobenzene SMILES: C1=C(C=C(C=C1Cl)Br)F
| PubChem CID | 2736223 |
|---|---|
| CAS | 33863-76-2 |
| Molecular Weight (g/mol) | 209.442 |
| MDL Number | MFCD00070747 |
| SMILES | C1=C(C=C(C=C1Cl)Br)F |
| Synonym | 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene |
| IUPAC Name | 1-bromo-3-chloro-5-fluorobenzene |
| InChI Key | GGMDFPMASIXEIR-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClF |
Benzyltrimethylammonium Tribromide 97.0+%, TCI America™
CAS: 111865-47-5 Molecular Formula: C10H17Br3N+ Molecular Weight (g/mol): 390.965 MDL Number: MFCD00134423 InChI Key: GSDDWZVWOXMLJZ-UHFFFAOYSA-N Synonym: benzyltrimethylammonium tribromide PubChem CID: 86222689 IUPAC Name: benzyl(trimethyl)azanium;molecular bromine;hydrobromide SMILES: C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr
| PubChem CID | 86222689 |
|---|---|
| CAS | 111865-47-5 |
| Molecular Weight (g/mol) | 390.965 |
| MDL Number | MFCD00134423 |
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr |
| Synonym | benzyltrimethylammonium tribromide |
| IUPAC Name | benzyl(trimethyl)azanium;molecular bromine;hydrobromide |
| InChI Key | GSDDWZVWOXMLJZ-UHFFFAOYSA-N |
| Molecular Formula | C10H17Br3N+ |
2,4'-Dihydroxybenzophenone 98.0+%, TCI America™
CAS: 606-12-2 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD02181674 InChI Key: HUYKZYIAFUBPAQ-UHFFFAOYSA-N PubChem CID: 220295 IUPAC Name: (2-hydroxyphenyl)-(4-hydroxyphenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)O
| PubChem CID | 220295 |
|---|---|
| CAS | 606-12-2 |
| Molecular Weight (g/mol) | 214.22 |
| MDL Number | MFCD02181674 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)O |
| IUPAC Name | (2-hydroxyphenyl)-(4-hydroxyphenyl)methanone |
| InChI Key | HUYKZYIAFUBPAQ-UHFFFAOYSA-N |
| Molecular Formula | C13H10O3 |