Benzene and substituted derivatives
Filtered Search Results
Levocetirizine Dihydrochloride 98.0+%, TCI America™
CAS: 130018-87-0 Molecular Formula: C21H27Cl3N2O3 Molecular Weight (g/mol): 461.808 MDL Number: MFCD07366507 InChI Key: PGLIUCLTXOYQMV-GHVWMZMZSA-N Synonym: 2-[2-[4-[(R)-(4-Chlorophenyl)phenylmethyl]piperazin-1-yl]ethoxy]acetic Acid Dihydrochloride PubChem CID: 9955977 IUPAC Name: 2-[2-[4-[(R)-(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetic acid;dihydrochloride SMILES: C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl
| PubChem CID | 9955977 |
|---|---|
| CAS | 130018-87-0 |
| Molecular Weight (g/mol) | 461.808 |
| MDL Number | MFCD07366507 |
| SMILES | C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl |
| Synonym | 2-[2-[4-[(R)-(4-Chlorophenyl)phenylmethyl]piperazin-1-yl]ethoxy]acetic Acid Dihydrochloride |
| IUPAC Name | 2-[2-[4-[(R)-(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetic acid;dihydrochloride |
| InChI Key | PGLIUCLTXOYQMV-GHVWMZMZSA-N |
| Molecular Formula | C21H27Cl3N2O3 |
1-Bromo-4-fluoro-2-iodobenzene 98.0+%, TCI America™
CAS: 202865-72-3 Molecular Formula: C6H3BrFI Molecular Weight (g/mol): 300.897 MDL Number: MFCD00042578 InChI Key: QDCBSSUCEUMLGC-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoroiodobenzene,4-fluoro-2-iodobromobenzene,2-iodo-4-fluorobromobenzene,1-bromo-4-fluoro-2-iodo-benzene,benzene, 1-bromo-4-fluoro-2-iodo,2-bromo-5-fluoro-1-iodobenzene,pubchem3233,acmc-1cljm,ksc493k3j,1-bromo-2-iodo-4-fluorobenzene PubChem CID: 2773370 IUPAC Name: 1-bromo-4-fluoro-2-iodobenzene SMILES: C1=CC(=C(C=C1F)I)Br
| PubChem CID | 2773370 |
|---|---|
| CAS | 202865-72-3 |
| Molecular Weight (g/mol) | 300.897 |
| MDL Number | MFCD00042578 |
| SMILES | C1=CC(=C(C=C1F)I)Br |
| Synonym | 2-bromo-5-fluoroiodobenzene,4-fluoro-2-iodobromobenzene,2-iodo-4-fluorobromobenzene,1-bromo-4-fluoro-2-iodo-benzene,benzene, 1-bromo-4-fluoro-2-iodo,2-bromo-5-fluoro-1-iodobenzene,pubchem3233,acmc-1cljm,ksc493k3j,1-bromo-2-iodo-4-fluorobenzene |
| IUPAC Name | 1-bromo-4-fluoro-2-iodobenzene |
| InChI Key | QDCBSSUCEUMLGC-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFI |
2-Methoxy-4-nitrobenzonitrile 97.0+%, TCI America™
CAS: 101084-96-2 Molecular Formula: C8H6N2O3 Molecular Weight (g/mol): 178.147 MDL Number: MFCD02093781 InChI Key: MLIKCKXLGYEGAO-UHFFFAOYSA-N Synonym: 2-cyano-5-nitroanisole,acmc-20a4y1,4-nitro-2-methoxybenzonitrile,2-methoxy-4-nitro-benzonitrile,2-methyloxy-4-nitrobenzonitrile,2-methoxy-4-nitrobenzonitrile PubChem CID: 291867 IUPAC Name: 2-methoxy-4-nitrobenzonitrile SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])C#N
| PubChem CID | 291867 |
|---|---|
| CAS | 101084-96-2 |
| Molecular Weight (g/mol) | 178.147 |
| MDL Number | MFCD02093781 |
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])C#N |
| Synonym | 2-cyano-5-nitroanisole,acmc-20a4y1,4-nitro-2-methoxybenzonitrile,2-methoxy-4-nitro-benzonitrile,2-methyloxy-4-nitrobenzonitrile,2-methoxy-4-nitrobenzonitrile |
| IUPAC Name | 2-methoxy-4-nitrobenzonitrile |
| InChI Key | MLIKCKXLGYEGAO-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O3 |
N-Benzyl-3,3'-iminodipropionic Acid 98.0+%, TCI America™
CAS: 6405-28-3 Molecular Formula: C13H17NO4 Molecular Weight (g/mol): 251.28 MDL Number: MFCD16327542 InChI Key: KSTIKMRBVZTNLX-UHFFFAOYSA-N PubChem CID: 56973687 IUPAC Name: 3-[benzyl(2-carboxyethyl)amino]propanoic acid SMILES: OC(=O)CCN(CCC(O)=O)CC1=CC=CC=C1
| PubChem CID | 56973687 |
|---|---|
| CAS | 6405-28-3 |
| Molecular Weight (g/mol) | 251.28 |
| MDL Number | MFCD16327542 |
| SMILES | OC(=O)CCN(CCC(O)=O)CC1=CC=CC=C1 |
| IUPAC Name | 3-[benzyl(2-carboxyethyl)amino]propanoic acid |
| InChI Key | KSTIKMRBVZTNLX-UHFFFAOYSA-N |
| Molecular Formula | C13H17NO4 |
Hexaethylene Glycol Monobenzyl Ether 93.0+%, TCI America™
CAS: 24342-68-5 Molecular Formula: C19H32O7 Molecular Weight (g/mol): 372.458 MDL Number: MFCD06797107 InChI Key: VVBQKDDPSXBMMZ-UHFFFAOYSA-N Synonym: 2-[2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol PubChem CID: 11164646 IUPAC Name: 2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C1=CC=C(C=C1)COCCOCCOCCOCCOCCOCCO
| PubChem CID | 11164646 |
|---|---|
| CAS | 24342-68-5 |
| Molecular Weight (g/mol) | 372.458 |
| MDL Number | MFCD06797107 |
| SMILES | C1=CC=C(C=C1)COCCOCCOCCOCCOCCOCCO |
| Synonym | 2-[2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| IUPAC Name | 2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | VVBQKDDPSXBMMZ-UHFFFAOYSA-N |
| Molecular Formula | C19H32O7 |
3,5-Dinitrobenzotrifluoride 98.0+%, TCI America™
CAS: 401-99-0 Molecular Formula: C7H3F3N2O4 Molecular Weight (g/mol): 236.106 MDL Number: MFCD00007233 InChI Key: QZADIXWDDVQVKM-UHFFFAOYSA-N PubChem CID: 123060 IUPAC Name: 1,3-dinitro-5-(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F
| PubChem CID | 123060 |
|---|---|
| CAS | 401-99-0 |
| Molecular Weight (g/mol) | 236.106 |
| MDL Number | MFCD00007233 |
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F |
| IUPAC Name | 1,3-dinitro-5-(trifluoromethyl)benzene |
| InChI Key | QZADIXWDDVQVKM-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3N2O4 |
(Trifluoromethyl)tris(triphenylphosphine)copper(I) 98.0+%, TCI America™
CAS: 325810-07-9 Molecular Formula: C55H45CuF3P3 Molecular Weight (g/mol): 919.427 InChI Key: ADEZRALRKPUAPZ-UHFFFAOYSA-N Synonym: Tris(triphenylphosphine)(trifluoromethyl)copper(I) PubChem CID: 85433410 IUPAC Name: copper(1+);trifluoromethane;triphenylphosphane SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[C-](F)(F)F.[Cu+]
| PubChem CID | 85433410 |
|---|---|
| CAS | 325810-07-9 |
| Molecular Weight (g/mol) | 919.427 |
| SMILES | C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[C-](F)(F)F.[Cu+] |
| Synonym | Tris(triphenylphosphine)(trifluoromethyl)copper(I) |
| IUPAC Name | copper(1+);trifluoromethane;triphenylphosphane |
| InChI Key | ADEZRALRKPUAPZ-UHFFFAOYSA-N |
| Molecular Formula | C55H45CuF3P3 |
4,4'-Butylidenebis(6-tert-butyl-m-cresol) 97.0+%, TCI America™
CAS: 85-60-9 Molecular Formula: C26H38O2 Molecular Weight (g/mol): 382.59 MDL Number: MFCD00026289 InChI Key: PFANXOISJYKQRP-UHFFFAOYSA-N Synonym: santowhite,santowhite powder,sumilit bbm,sumilizer bbm,anullex pba 15,4,4'-butylidenebis 6-tert-butyl-m-cresol,yoshinox bb,sumilizer bbm-s,swp antioxidant,noclizer ns 30 PubChem CID: 6815 IUPAC Name: 2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol SMILES: CCCC(C1=CC(=C(O)C=C1C)C(C)(C)C)C1=CC(=C(O)C=C1C)C(C)(C)C
| PubChem CID | 6815 |
|---|---|
| CAS | 85-60-9 |
| Molecular Weight (g/mol) | 382.59 |
| MDL Number | MFCD00026289 |
| SMILES | CCCC(C1=CC(=C(O)C=C1C)C(C)(C)C)C1=CC(=C(O)C=C1C)C(C)(C)C |
| Synonym | santowhite,santowhite powder,sumilit bbm,sumilizer bbm,anullex pba 15,4,4'-butylidenebis 6-tert-butyl-m-cresol,yoshinox bb,sumilizer bbm-s,swp antioxidant,noclizer ns 30 |
| IUPAC Name | 2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol |
| InChI Key | PFANXOISJYKQRP-UHFFFAOYSA-N |
| Molecular Formula | C26H38O2 |
6-Acetyl-2-benzoxazolinone 98.0+%, TCI America™
CAS: 54903-09-2 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD01664312 InChI Key: QXBNAXVXLAHDTE-UHFFFAOYSA-N Synonym: 6-acetyl-2 3h-benzoxazolone,2 3h-benzoxazolone, 6-acetyl,jpb 2,6-acetyl-2-benzoxazolinone,6-acetylbenzo d oxazol-2 3h-one,6-acetyl-2,3-dihydro-1,3-benzoxazol-2-one,acetyl-6 benzoxazolinone french,6-acetyl-3h-benzooxazol-2-one,6-acetyl-1,3-benzoxazol-2 3h-one,6-acetyl-2-oxo-3-hydrobenzoxazole PubChem CID: 689054 IUPAC Name: 6-acetyl-3H-1,3-benzoxazol-2-one SMILES: CC(=O)C1=CC2=C(C=C1)NC(=O)O2
| PubChem CID | 689054 |
|---|---|
| CAS | 54903-09-2 |
| Molecular Weight (g/mol) | 177.159 |
| MDL Number | MFCD01664312 |
| SMILES | CC(=O)C1=CC2=C(C=C1)NC(=O)O2 |
| Synonym | 6-acetyl-2 3h-benzoxazolone,2 3h-benzoxazolone, 6-acetyl,jpb 2,6-acetyl-2-benzoxazolinone,6-acetylbenzo d oxazol-2 3h-one,6-acetyl-2,3-dihydro-1,3-benzoxazol-2-one,acetyl-6 benzoxazolinone french,6-acetyl-3h-benzooxazol-2-one,6-acetyl-1,3-benzoxazol-2 3h-one,6-acetyl-2-oxo-3-hydrobenzoxazole |
| IUPAC Name | 6-acetyl-3H-1,3-benzoxazol-2-one |
| InChI Key | QXBNAXVXLAHDTE-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO3 |
3-Iodobenzyl Bromide 97.0+%, TCI America™
CAS: 49617-83-6 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 InChI Key: BACZSVQZBSCWIG-UHFFFAOYSA-N Synonym: 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide PubChem CID: 2759361 IUPAC Name: 1-(bromomethyl)-3-iodobenzene SMILES: C1=CC(=CC(=C1)I)CBr
| PubChem CID | 2759361 |
|---|---|
| CAS | 49617-83-6 |
| Molecular Weight (g/mol) | 296.933 |
| SMILES | C1=CC(=CC(=C1)I)CBr |
| Synonym | 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide |
| IUPAC Name | 1-(bromomethyl)-3-iodobenzene |
| InChI Key | BACZSVQZBSCWIG-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrI |
Methyl 3-Iodo-4-methylbenzoate 98.0+%, TCI America™
CAS: 90347-66-3 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD00230583 InChI Key: NKMHAOTZPFVSPC-UHFFFAOYSA-N Synonym: 3-iodo-4-methylbenzoic acid methyl ester,methyl 3-iodo-p-toluate,methyl-3-iodo-4-methylbenzoate,methyl 3-iodo-4-methyl-benzoate,2-iodo-4-methoxycarbonyl toluene,benzoic acid, 3-iodo-4-methyl-, methyl ester,methyl3-iodo-4-methylbenzoate,3-iodo-4-methylbenzoic acidmethyl ester,methyl 3-iodo-4-meth,ksc495m1r PubChem CID: 13614033 IUPAC Name: methyl 3-iodo-4-methylbenzoate SMILES: CC1=C(C=C(C=C1)C(=O)OC)I
| PubChem CID | 13614033 |
|---|---|
| CAS | 90347-66-3 |
| Molecular Weight (g/mol) | 276.073 |
| MDL Number | MFCD00230583 |
| SMILES | CC1=C(C=C(C=C1)C(=O)OC)I |
| Synonym | 3-iodo-4-methylbenzoic acid methyl ester,methyl 3-iodo-p-toluate,methyl-3-iodo-4-methylbenzoate,methyl 3-iodo-4-methyl-benzoate,2-iodo-4-methoxycarbonyl toluene,benzoic acid, 3-iodo-4-methyl-, methyl ester,methyl3-iodo-4-methylbenzoate,3-iodo-4-methylbenzoic acidmethyl ester,methyl 3-iodo-4-meth,ksc495m1r |
| IUPAC Name | methyl 3-iodo-4-methylbenzoate |
| InChI Key | NKMHAOTZPFVSPC-UHFFFAOYSA-N |
| Molecular Formula | C9H9IO2 |
3-Chlorobenzohydrazide 98.0+%, TCI America™
CAS: 1673-47-8 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.596 MDL Number: MFCD00014757 InChI Key: PHRDZSRVSVNQRN-UHFFFAOYSA-N Synonym: 3-chlorobenzhydrazide,3-chlorobenzenecarbohydrazide,3-chlorobenzoic hydrazide,benzoic acid, 3-chloro-, hydrazide,3-chlorobenzoylhydrazine,3-chlorobenzoic acid hydrazide,3-chloro-benzoic acid hydrazide,benzoylhydrazine, m-chloro,3-chlorobenzoic acid, hydrazide,3-chlorobenzhyrazide PubChem CID: 74289 IUPAC Name: 3-chlorobenzohydrazide SMILES: C1=CC(=CC(=C1)Cl)C(=O)NN
| PubChem CID | 74289 |
|---|---|
| CAS | 1673-47-8 |
| Molecular Weight (g/mol) | 170.596 |
| MDL Number | MFCD00014757 |
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)NN |
| Synonym | 3-chlorobenzhydrazide,3-chlorobenzenecarbohydrazide,3-chlorobenzoic hydrazide,benzoic acid, 3-chloro-, hydrazide,3-chlorobenzoylhydrazine,3-chlorobenzoic acid hydrazide,3-chloro-benzoic acid hydrazide,benzoylhydrazine, m-chloro,3-chlorobenzoic acid, hydrazide,3-chlorobenzhyrazide |
| IUPAC Name | 3-chlorobenzohydrazide |
| InChI Key | PHRDZSRVSVNQRN-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClN2O |
4-Fluoro-DL-mandelic Acid 96.0+%, TCI America™
CAS: 395-33-5 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.14 MDL Number: MFCD00044402,MFCD20638902 InChI Key: RWCMOQXHIDWDDJ-UHFFFAOYNA-N Synonym: 4-fluoromandelic acid,2-4-fluorophenyl-2-hydroxyacetic acid,p-fluoro mandelic acid,4-fluorophenyl hydroxy acetic acid,p-fluoromandelic acid,4-fluoro mandelic acid,4-fluoromandelicacid,4-fluoro-alpha-hydroxybenzeneacetic acid,4-fluoro-dl-mandelic acid,4-fluoro hydroxy acetic acid PubChem CID: 98068 IUPAC Name: 2-(4-fluorophenyl)-2-hydroxyacetic acid SMILES: OC(C(O)=O)C1=CC=C(F)C=C1
| PubChem CID | 98068 |
|---|---|
| CAS | 395-33-5 |
| Molecular Weight (g/mol) | 170.14 |
| MDL Number | MFCD00044402,MFCD20638902 |
| SMILES | OC(C(O)=O)C1=CC=C(F)C=C1 |
| Synonym | 4-fluoromandelic acid,2-4-fluorophenyl-2-hydroxyacetic acid,p-fluoro mandelic acid,4-fluorophenyl hydroxy acetic acid,p-fluoromandelic acid,4-fluoro mandelic acid,4-fluoromandelicacid,4-fluoro-alpha-hydroxybenzeneacetic acid,4-fluoro-dl-mandelic acid,4-fluoro hydroxy acetic acid |
| IUPAC Name | 2-(4-fluorophenyl)-2-hydroxyacetic acid |
| InChI Key | RWCMOQXHIDWDDJ-UHFFFAOYNA-N |
| Molecular Formula | C8H7FO3 |
2-(Methylthio)benzoic Acid 98.0+%, TCI America™
CAS: 3724-10-5 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00029934 InChI Key: LWJQGKJCZOGGPJ-UHFFFAOYSA-N Synonym: 2-methylthio benzoic acid,benzoic acid, 2-methylthio,o-methylthio benzoic acid,benzoic acid, o-methylthio,2-methylsulfanyl benzoic acid,2-methylmercaptobenzoic acid,2-carboxyphenyl methyl sulfide,acide methyl-s-2-benzoique,2-methylmercapto benzoic acid,acide methyl-s-2-benzoique french PubChem CID: 19498 IUPAC Name: 2-methylsulfanylbenzoic acid SMILES: CSC1=CC=CC=C1C(=O)O
| PubChem CID | 19498 |
|---|---|
| CAS | 3724-10-5 |
| Molecular Weight (g/mol) | 168.21 |
| MDL Number | MFCD00029934 |
| SMILES | CSC1=CC=CC=C1C(=O)O |
| Synonym | 2-methylthio benzoic acid,benzoic acid, 2-methylthio,o-methylthio benzoic acid,benzoic acid, o-methylthio,2-methylsulfanyl benzoic acid,2-methylmercaptobenzoic acid,2-carboxyphenyl methyl sulfide,acide methyl-s-2-benzoique,2-methylmercapto benzoic acid,acide methyl-s-2-benzoique french |
| IUPAC Name | 2-methylsulfanylbenzoic acid |
| InChI Key | LWJQGKJCZOGGPJ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2S |
1-Bromo-4-(trifluoromethoxy)benzene 98.0+%, TCI America™
CAS: 407-14-7 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.01 MDL Number: MFCD00040834 InChI Key: SEAOBYFQWJFORM-UHFFFAOYSA-N Synonym: 1-bromo-4-trifluoromethoxy benzene,4-trifluoromethoxy bromobenzene,4-bromo trifluoromethoxy benzene,4-trifluoromethoxybromobenzene,p-bromotrifluoromethoxybenzene,benzene, 1-bromo-4-trifluoromethoxy,4-bromo-1-trifluoromethoxy benzene,p-trifluoromethoxybromobenzene,4-bromotrifluoromethoxybenzene,4-bromo-trifluoromethoxybenzene PubChem CID: 521008 IUPAC Name: 1-bromo-4-(trifluoromethoxy)benzene SMILES: FC(F)(F)OC1=CC=C(Br)C=C1
| PubChem CID | 521008 |
|---|---|
| CAS | 407-14-7 |
| Molecular Weight (g/mol) | 241.01 |
| MDL Number | MFCD00040834 |
| SMILES | FC(F)(F)OC1=CC=C(Br)C=C1 |
| Synonym | 1-bromo-4-trifluoromethoxy benzene,4-trifluoromethoxy bromobenzene,4-bromo trifluoromethoxy benzene,4-trifluoromethoxybromobenzene,p-bromotrifluoromethoxybenzene,benzene, 1-bromo-4-trifluoromethoxy,4-bromo-1-trifluoromethoxy benzene,p-trifluoromethoxybromobenzene,4-bromotrifluoromethoxybenzene,4-bromo-trifluoromethoxybenzene |
| IUPAC Name | 1-bromo-4-(trifluoromethoxy)benzene |
| InChI Key | SEAOBYFQWJFORM-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3O |