Benzene and substituted derivatives
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3-(4-Bromophenyl)-5-methyl-1,2,4-oxadiazole, 97%, Thermo Scientific™
CAS: 118183-92-9 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 MDL Number: MFCD00487341 InChI Key: YWBIOYGLRGIJRT-UHFFFAOYSA-N PubChem CID: 823560 IUPAC Name: 3-(4-bromophenyl)-5-methyl-1,2,4-oxadiazole SMILES: CC1=NC(=NO1)C2=CC=C(C=C2)Br
| PubChem CID | 823560 |
|---|---|
| CAS | 118183-92-9 |
| Molecular Weight (g/mol) | 239.072 |
| MDL Number | MFCD00487341 |
| SMILES | CC1=NC(=NO1)C2=CC=C(C=C2)Br |
| IUPAC Name | 3-(4-bromophenyl)-5-methyl-1,2,4-oxadiazole |
| InChI Key | YWBIOYGLRGIJRT-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrN2O |
4-Bromotoluene, 98%
CAS: 106-38-7 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000109 InChI Key: ZBTMRBYMKUEVEU-UHFFFAOYSA-N Synonym: 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene PubChem CID: 7805 IUPAC Name: 1-bromo-4-methylbenzene SMILES: CC1=CC=C(Br)C=C1
| PubChem CID | 7805 |
|---|---|
| CAS | 106-38-7 |
| Molecular Weight (g/mol) | 171.04 |
| MDL Number | MFCD00000109 |
| SMILES | CC1=CC=C(Br)C=C1 |
| Synonym | 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene |
| IUPAC Name | 1-bromo-4-methylbenzene |
| InChI Key | ZBTMRBYMKUEVEU-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br |
1-Bromo-4-n-octylbenzene, 97%
CAS: 51554-93-9 Molecular Formula: C14H21Br Molecular Weight (g/mol): 269.226 MDL Number: MFCD00038348 InChI Key: OOZQSVXPBCINJF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene PubChem CID: 142854 IUPAC Name: 1-bromo-4-octylbenzene SMILES: CCCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 142854 |
|---|---|
| CAS | 51554-93-9 |
| Molecular Weight (g/mol) | 269.226 |
| MDL Number | MFCD00038348 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene |
| IUPAC Name | 1-bromo-4-octylbenzene |
| InChI Key | OOZQSVXPBCINJF-UHFFFAOYSA-N |
| Molecular Formula | C14H21Br |
1-Bromo-2,4-dinitrobenzene, MP Biomedicals
CAS: 584-48-5 Molecular Formula: C6H3BrN2O4 Molecular Weight (g/mol): 247.004 InChI Key: PBOPJYORIDJAFE-UHFFFAOYSA-N Synonym: 2,4-dinitrobromobenzene,4-bromo-1,3-dinitrobenzene,o,p-dinitrophenyl bromide,2,4-dinitrophenyl bromide,dnbb,benzene, 1-bromo-2,4-dinitro,2, 4-dinitrobromobenzene,1-bromo-2,4-dinitrobenze,unii-4ms3ftw380,ccris 1801 PubChem CID: 11441 ChEBI: CHEBI:58999 IUPAC Name: 1-bromo-2,4-dinitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br
| PubChem CID | 11441 |
|---|---|
| CAS | 584-48-5 |
| Molecular Weight (g/mol) | 247.004 |
| ChEBI | CHEBI:58999 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br |
| Synonym | 2,4-dinitrobromobenzene,4-bromo-1,3-dinitrobenzene,o,p-dinitrophenyl bromide,2,4-dinitrophenyl bromide,dnbb,benzene, 1-bromo-2,4-dinitro,2, 4-dinitrobromobenzene,1-bromo-2,4-dinitrobenze,unii-4ms3ftw380,ccris 1801 |
| IUPAC Name | 1-bromo-2,4-dinitrobenzene |
| InChI Key | PBOPJYORIDJAFE-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrN2O4 |
4-Bromo-2-fluoroaniline, 98+%
CAS: 367-24-8 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.015 MDL Number: MFCD00010221 InChI Key: GZRMNMGWNKSANY-UHFFFAOYSA-N Synonym: 2-fluoro-4-bromoaniline,benzenamine, 4-bromo-2-fluoro,4-bromo-2-fluoro-phenylamine,4-bromo-2-fluoro-aniline,4-bromo-2-fluorobenzenamine,4-bromo-2-fluoro aniline,4-bromo-2-fluorophenylamine,4-brom-2-fluoranilin,zlchem 545,pubchem1525 PubChem CID: 123050 IUPAC Name: 4-bromo-2-fluoroaniline SMILES: C1=CC(=C(C=C1Br)F)N
| PubChem CID | 123050 |
|---|---|
| CAS | 367-24-8 |
| Molecular Weight (g/mol) | 190.015 |
| MDL Number | MFCD00010221 |
| SMILES | C1=CC(=C(C=C1Br)F)N |
| Synonym | 2-fluoro-4-bromoaniline,benzenamine, 4-bromo-2-fluoro,4-bromo-2-fluoro-phenylamine,4-bromo-2-fluoro-aniline,4-bromo-2-fluorobenzenamine,4-bromo-2-fluoro aniline,4-bromo-2-fluorophenylamine,4-brom-2-fluoranilin,zlchem 545,pubchem1525 |
| IUPAC Name | 4-bromo-2-fluoroaniline |
| InChI Key | GZRMNMGWNKSANY-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrFN |
Bromopentamethylbenzene, 98%
CAS: 5153-40-2 Molecular Formula: C11H15Br Molecular Weight (g/mol): 227.15 MDL Number: MFCD00013523 InChI Key: XPDQRULPGCFCLX-UHFFFAOYSA-N Synonym: bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene PubChem CID: 78831 IUPAC Name: 1-bromo-2,3,4,5,6-pentamethylbenzene SMILES: CC1=C(C)C(C)=C(Br)C(C)=C1C
| PubChem CID | 78831 |
|---|---|
| CAS | 5153-40-2 |
| Molecular Weight (g/mol) | 227.15 |
| MDL Number | MFCD00013523 |
| SMILES | CC1=C(C)C(C)=C(Br)C(C)=C1C |
| Synonym | bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene |
| IUPAC Name | 1-bromo-2,3,4,5,6-pentamethylbenzene |
| InChI Key | XPDQRULPGCFCLX-UHFFFAOYSA-N |
| Molecular Formula | C11H15Br |
1-Bromo-2,4-dichlorobenzene, 98%
CAS: 1193-72-2 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00018333 InChI Key: ISHYFWKKWKXXPL-UHFFFAOYSA-N Synonym: 2,4-dichlorobromobenzene,bromo 2--4-dichlorobenzene,1-bromo-2,4-dichloro-benzene,benzene, 1-bromo-2,4-dichloro,pubchem3608,2,4-dichlorobromobenze,2,4-dichloro-bromobenzene,acmc-209a2k,2,4-dichloro-1-bromobenzene,ksc490m9l PubChem CID: 70947 IUPAC Name: 1-bromo-2,4-dichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)Br
| PubChem CID | 70947 |
|---|---|
| CAS | 1193-72-2 |
| Molecular Weight (g/mol) | 225.894 |
| MDL Number | MFCD00018333 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)Br |
| Synonym | 2,4-dichlorobromobenzene,bromo 2--4-dichlorobenzene,1-bromo-2,4-dichloro-benzene,benzene, 1-bromo-2,4-dichloro,pubchem3608,2,4-dichlorobromobenze,2,4-dichloro-bromobenzene,acmc-209a2k,2,4-dichloro-1-bromobenzene,ksc490m9l |
| IUPAC Name | 1-bromo-2,4-dichlorobenzene |
| InChI Key | ISHYFWKKWKXXPL-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrCl2 |
m-Bromotoluene, MP Biomedicals
CAS: 591-17-3 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000085 InChI Key: WJIFKOVZNJTSGO-UHFFFAOYSA-N Synonym: 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene PubChem CID: 11560 IUPAC Name: 1-bromo-3-methylbenzene SMILES: CC1=CC=CC(Br)=C1
| PubChem CID | 11560 |
|---|---|
| CAS | 591-17-3 |
| Molecular Weight (g/mol) | 171.04 |
| MDL Number | MFCD00000085 |
| SMILES | CC1=CC=CC(Br)=C1 |
| Synonym | 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene |
| IUPAC Name | 1-bromo-3-methylbenzene |
| InChI Key | WJIFKOVZNJTSGO-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br |
(1-Ethoxycarbonylcyclopropyl)triphenylphosphonium tetrafluoroborate, 98%
CAS: 52186-89-7 Molecular Formula: C24H24BF4O2P Molecular Weight (g/mol): 462.23 MDL Number: MFCD00051879 InChI Key: RGJYRMUGSAFITK-UHFFFAOYSA-N Synonym: 1-carbethoxycyclopropyltriphenylphosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl triphenylphosphonium tetrafluoroborate,1-ethoxycarbonylcyclopropyl triphenylphosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl tris phenyl phosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl triphenylphosphanium tetrafluoroborate,acmc-20aowe,1-carboethoxycyclopropyl triphenylphosphonium tetrafluoroborate,1-carbethoxycyclopropyl tris phenyl phosphonium tetrafluoroborate,1-ethoxycarbonylcyclopropyl-triphenyl-phosphanium tetrafluoroborate,1-ethoxycarbonylcyclopropyl-triphenyl-phosphonium tetrafluoroborate PubChem CID: 11016017 SMILES: F[B-](F)(F)F.CCOC(=O)C1(CC1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 11016017 |
|---|---|
| CAS | 52186-89-7 |
| Molecular Weight (g/mol) | 462.23 |
| MDL Number | MFCD00051879 |
| SMILES | F[B-](F)(F)F.CCOC(=O)C1(CC1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1-carbethoxycyclopropyltriphenylphosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl triphenylphosphonium tetrafluoroborate,1-ethoxycarbonylcyclopropyl triphenylphosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl tris phenyl phosphonium tetrafluoroborate,1-ethoxycarbonyl cyclopropyl triphenylphosphanium tetrafluoroborate,acmc-20aowe,1-carboethoxycyclopropyl triphenylphosphonium tetrafluoroborate,1-carbethoxycyclopropyl tris phenyl phosphonium tetrafluoroborate,1-ethoxycarbonylcyclopropyl-triphenyl-phosphanium tetrafluoroborate,1-ethoxycarbonylcyclopropyl-triphenyl-phosphonium tetrafluoroborate |
| InChI Key | RGJYRMUGSAFITK-UHFFFAOYSA-N |
| Molecular Formula | C24H24BF4O2P |
Tris(pentafluorophenyl)phosphine, 95%
CAS: 1259-35-4 Molecular Formula: C18F15P Molecular Weight (g/mol): 532.15 MDL Number: MFCD00079654 InChI Key: FQLSDFNKTNBQLC-UHFFFAOYSA-N Synonym: tris pentafluorophenyl phosphine,phosphine, tris pentafluorophenyl,tris perfluorophenyl phosphine,tris pentafluorophenyl phosphane,tris 2,3,4,5,6-pentafluorophenyl phosphane,pubchem6422,acmc-1bogg,ksc491k1f,tris-pentafluorophenyl-phosphane PubChem CID: 102076 IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)phosphane SMILES: FC1=C(F)C(F)=C(P(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F
| PubChem CID | 102076 |
|---|---|
| CAS | 1259-35-4 |
| Molecular Weight (g/mol) | 532.15 |
| MDL Number | MFCD00079654 |
| SMILES | FC1=C(F)C(F)=C(P(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F |
| Synonym | tris pentafluorophenyl phosphine,phosphine, tris pentafluorophenyl,tris perfluorophenyl phosphine,tris pentafluorophenyl phosphane,tris 2,3,4,5,6-pentafluorophenyl phosphane,pubchem6422,acmc-1bogg,ksc491k1f,tris-pentafluorophenyl-phosphane |
| IUPAC Name | tris(2,3,4,5,6-pentafluorophenyl)phosphane |
| InChI Key | FQLSDFNKTNBQLC-UHFFFAOYSA-N |
| Molecular Formula | C18F15P |
cis-Dichlorobis(triphenylphosphine)platinum(II), Premion™, 99.95% (metals basis), Pt 24.2% min
CAS: 15604-36-1 Molecular Formula: C36H30Cl2P2Pt Molecular Weight (g/mol): 790.57 MDL Number: MFCD00010825 InChI Key: ILIBUWCDNDIUOT-UHFFFAOYSA-L Synonym: cis-?dichlorobis triphenylphosphine ?platinum ii PubChem CID: 131667321 IUPAC Name: platinum(2+);triphenylphosphane;dihydrochloride SMILES: Cl[Pt++]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 131667321 |
|---|---|
| CAS | 15604-36-1 |
| Molecular Weight (g/mol) | 790.57 |
| MDL Number | MFCD00010825 |
| SMILES | Cl[Pt++]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | cis-?dichlorobis triphenylphosphine ?platinum ii |
| IUPAC Name | platinum(2+);triphenylphosphane;dihydrochloride |
| InChI Key | ILIBUWCDNDIUOT-UHFFFAOYSA-L |
| Molecular Formula | C36H30Cl2P2Pt |
Ethyl 3-bromobenzoate, 98%
CAS: 24398-88-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.08 MDL Number: MFCD00013529 InChI Key: QAUASTLEZAPQTB-UHFFFAOYSA-N PubChem CID: 90488 IUPAC Name: ethyl 3-bromobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)Br
| PubChem CID | 90488 |
|---|---|
| CAS | 24398-88-7 |
| Molecular Weight (g/mol) | 229.08 |
| MDL Number | MFCD00013529 |
| SMILES | CCOC(=O)C1=CC(=CC=C1)Br |
| IUPAC Name | ethyl 3-bromobenzoate |
| InChI Key | QAUASTLEZAPQTB-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
N1-(4-Amino-2-methylphenyl)acetamide, 90%, Thermo Scientific™
CAS: 56891-59-9 Molecular Formula: C9H12N2O Molecular Weight (g/mol): 164.208 MDL Number: MFCD00276633 InChI Key: GWFPMSIIVJMYRZ-UHFFFAOYSA-N Synonym: n-4-amino-2-methylphenyl acetamide,n1-4-amino-2-methylphenyl acetamide,4'-amino-2'-methylacetanilide,n-4-amino-2-methyl-phenyl-acetamide,4-acetamido-m-toluidine,4-acetylamino-m-toluidine,4-acetamido-3-methylaniline,4-acetamino-3-methylaniline,acetamide, n-4-amino-2-methylphenyl PubChem CID: 314338 IUPAC Name: N-(4-amino-2-methylphenyl)acetamide SMILES: CC1=C(C=CC(=C1)N)NC(=O)C
| PubChem CID | 314338 |
|---|---|
| CAS | 56891-59-9 |
| Molecular Weight (g/mol) | 164.208 |
| MDL Number | MFCD00276633 |
| SMILES | CC1=C(C=CC(=C1)N)NC(=O)C |
| Synonym | n-4-amino-2-methylphenyl acetamide,n1-4-amino-2-methylphenyl acetamide,4'-amino-2'-methylacetanilide,n-4-amino-2-methyl-phenyl-acetamide,4-acetamido-m-toluidine,4-acetylamino-m-toluidine,4-acetamido-3-methylaniline,4-acetamino-3-methylaniline,acetamide, n-4-amino-2-methylphenyl |
| IUPAC Name | N-(4-amino-2-methylphenyl)acetamide |
| InChI Key | GWFPMSIIVJMYRZ-UHFFFAOYSA-N |
| Molecular Formula | C9H12N2O |
2'-Aminoacetanilide, 98%
CAS: 34801-09-7 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.18 MDL Number: MFCD00210388 InChI Key: MPXAYYWSDIKNTP-UHFFFAOYSA-N Synonym: n-2-aminophenyl acetamide,2'-aminoacetanilide,o-aminoacetanilide,acetamide, n-2-aminophenyl,unii-lb34xrq95v,lb34xrq95v,acetamide, n-2-aminophenyl-9ci,n-acetyl-2-aminoaniline,n-acetyl-o-phenylenediamine,2-aminoactanilide PubChem CID: 11149 IUPAC Name: N-(2-aminophenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1N
| PubChem CID | 11149 |
|---|---|
| CAS | 34801-09-7 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00210388 |
| SMILES | CC(=O)NC1=CC=CC=C1N |
| Synonym | n-2-aminophenyl acetamide,2'-aminoacetanilide,o-aminoacetanilide,acetamide, n-2-aminophenyl,unii-lb34xrq95v,lb34xrq95v,acetamide, n-2-aminophenyl-9ci,n-acetyl-2-aminoaniline,n-acetyl-o-phenylenediamine,2-aminoactanilide |
| IUPAC Name | N-(2-aminophenyl)acetamide |
| InChI Key | MPXAYYWSDIKNTP-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O |
3'-Nitroacetanilide, 98+%
CAS: 122-28-1 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 MDL Number: MFCD00017015 InChI Key: KFTYNYHJHKCRKU-UHFFFAOYSA-N Synonym: n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp PubChem CID: 31206 IUPAC Name: N-(3-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]
| PubChem CID | 31206 |
|---|---|
| CAS | 122-28-1 |
| Molecular Weight (g/mol) | 180.163 |
| MDL Number | MFCD00017015 |
| SMILES | CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-] |
| Synonym | n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp |
| IUPAC Name | N-(3-nitrophenyl)acetamide |
| InChI Key | KFTYNYHJHKCRKU-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O3 |