Benzene and substituted derivatives
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2,4-Dibromo-6-nitroaniline 98.0+%, TCI America™
CAS: 827-23-6 Molecular Formula: C6H4Br2N2O2 Molecular Weight (g/mol): 295.918 MDL Number: MFCD00012107 InChI Key: OBTUHOVIVLDLLD-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dibromo-6-nitro,2,4-dibromo-6-nitrophenylamine,2,4-dibromo-6-nitrobenzenamine,acmc-209pq0,2-nitro-4,6-dibromoaniline,4,6-dibromo-2-nitroaniline,2,4-dibromo-6-nitro-aniline,2,4-dibromo-6-nitro-phenylamine,aniline, 2,4-dibromo-6-nitro,benzenamine,2,4-dibromo-6-nitro PubChem CID: 70009 IUPAC Name: 2,4-dibromo-6-nitroaniline SMILES: C1=C(C=C(C(=C1Br)N)[N+](=O)[O-])Br
| PubChem CID | 70009 |
|---|---|
| CAS | 827-23-6 |
| Molecular Weight (g/mol) | 295.918 |
| MDL Number | MFCD00012107 |
| SMILES | C1=C(C=C(C(=C1Br)N)[N+](=O)[O-])Br |
| Synonym | benzenamine, 2,4-dibromo-6-nitro,2,4-dibromo-6-nitrophenylamine,2,4-dibromo-6-nitrobenzenamine,acmc-209pq0,2-nitro-4,6-dibromoaniline,4,6-dibromo-2-nitroaniline,2,4-dibromo-6-nitro-aniline,2,4-dibromo-6-nitro-phenylamine,aniline, 2,4-dibromo-6-nitro,benzenamine,2,4-dibromo-6-nitro |
| IUPAC Name | 2,4-dibromo-6-nitroaniline |
| InChI Key | OBTUHOVIVLDLLD-UHFFFAOYSA-N |
| Molecular Formula | C6H4Br2N2O2 |
1,4-Dibromo-2-fluorobenzene 98.0+%, TCI America™
CAS: 1435-52-5 Molecular Formula: C6H3Br2F Molecular Weight (g/mol): 253.896 MDL Number: MFCD00010603 InChI Key: WNSNPGHNIJOOPM-UHFFFAOYSA-N Synonym: 2,5-dibromo-fluorobenzene,2-fluoro-4-bromobromobenzene,4-bromo-2-fluorobromobenzene,2,5-dibromofluorobenzene,benzene, 1,4-dibromo-2-fluoro,1,4-dibromo-2-fluorobenzene,2,5-dibromo-1-fluorobenzene,pubchem3448,ksc494g9h,1,4-dibromo-2-fluoro-benzene PubChem CID: 137004 IUPAC Name: 1,4-dibromo-2-fluorobenzene SMILES: C1=CC(=C(C=C1Br)F)Br
| PubChem CID | 137004 |
|---|---|
| CAS | 1435-52-5 |
| Molecular Weight (g/mol) | 253.896 |
| MDL Number | MFCD00010603 |
| SMILES | C1=CC(=C(C=C1Br)F)Br |
| Synonym | 2,5-dibromo-fluorobenzene,2-fluoro-4-bromobromobenzene,4-bromo-2-fluorobromobenzene,2,5-dibromofluorobenzene,benzene, 1,4-dibromo-2-fluoro,1,4-dibromo-2-fluorobenzene,2,5-dibromo-1-fluorobenzene,pubchem3448,ksc494g9h,1,4-dibromo-2-fluoro-benzene |
| IUPAC Name | 1,4-dibromo-2-fluorobenzene |
| InChI Key | WNSNPGHNIJOOPM-UHFFFAOYSA-N |
| Molecular Formula | C6H3Br2F |
Diphenylacetyl Chloride 98.0+%, TCI America™
CAS: 1871-76-7 Molecular Formula: C14H11ClO Molecular Weight (g/mol): 230.691 MDL Number: MFCD00013655 InChI Key: MSYLETHDEIJMAF-UHFFFAOYSA-N Synonym: diphenylacetyl chloride,diphenylacetic acid chloride,diphenylacetylchloride,acetyl chloride, diphenyl,unii-6553c1cb9s,alpha-phenylbenzeneacetyl chloride,diphenyl-acetyl chloride,benzeneacetyl chloride, .alpha.-phenyl,a-phenylbenzeneacetyl chloride,diphenyl acetyl chloride PubChem CID: 74637 IUPAC Name: 2,2-diphenylacetyl chloride SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)Cl
| PubChem CID | 74637 |
|---|---|
| CAS | 1871-76-7 |
| Molecular Weight (g/mol) | 230.691 |
| MDL Number | MFCD00013655 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)Cl |
| Synonym | diphenylacetyl chloride,diphenylacetic acid chloride,diphenylacetylchloride,acetyl chloride, diphenyl,unii-6553c1cb9s,alpha-phenylbenzeneacetyl chloride,diphenyl-acetyl chloride,benzeneacetyl chloride, .alpha.-phenyl,a-phenylbenzeneacetyl chloride,diphenyl acetyl chloride |
| IUPAC Name | 2,2-diphenylacetyl chloride |
| InChI Key | MSYLETHDEIJMAF-UHFFFAOYSA-N |
| Molecular Formula | C14H11ClO |
1,2-Difluoro-4-iodobenzene (stabilized with Copper chip) 98.0+%, TCI America™
CAS: 64248-58-4 Molecular Formula: C6H3F2I Molecular Weight (g/mol): 239.99 MDL Number: MFCD00044630 InChI Key: KSASJELKLBIMSG-UHFFFAOYSA-N Synonym: 3,4-difluoroiodobenzene,1,2-difluoro-4-iodo-benzene,benzene, 1,2-difluoro-4-iodo,3,4-difluoro iodobenzene,pubchem3461,3,4-difluoro-iodobenzene,3,4-difluorophenyl iodide,3,4-difluoro-1-iodobenzene,1-iodo-3,4-difluoro-benzene PubChem CID: 2724444 IUPAC Name: 1,2-difluoro-4-iodobenzene SMILES: FC1=C(F)C=C(I)C=C1
| PubChem CID | 2724444 |
|---|---|
| CAS | 64248-58-4 |
| Molecular Weight (g/mol) | 239.99 |
| MDL Number | MFCD00044630 |
| SMILES | FC1=C(F)C=C(I)C=C1 |
| Synonym | 3,4-difluoroiodobenzene,1,2-difluoro-4-iodo-benzene,benzene, 1,2-difluoro-4-iodo,3,4-difluoro iodobenzene,pubchem3461,3,4-difluoro-iodobenzene,3,4-difluorophenyl iodide,3,4-difluoro-1-iodobenzene,1-iodo-3,4-difluoro-benzene |
| IUPAC Name | 1,2-difluoro-4-iodobenzene |
| InChI Key | KSASJELKLBIMSG-UHFFFAOYSA-N |
| Molecular Formula | C6H3F2I |
Methyl(diphenyl)phosphine Oxide 98.0+%, TCI America™
CAS: 2129-89-7 Molecular Formula: C13H13OP Molecular Weight (g/mol): 216.22 MDL Number: MFCD00002081 InChI Key: PEGCITODQASXKH-UHFFFAOYSA-N Synonym: methyldiphenylphosphine oxide,methyl diphenyl phosphine oxide,diphenylmethylphosphine oxide,phosphine oxide, methyldiphenyl,phosphine oxide, diphenylmethyl,methyl-phenylphosphoryl benzene,methyl phenyl phosphoryl benzene,methyl phenyl phosphoroso benzene,methyldiphenylphosphineoxide PubChem CID: 75041 IUPAC Name: [methyl(phenyl)phosphoroso]benzene SMILES: CP(=O)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 75041 |
|---|---|
| CAS | 2129-89-7 |
| Molecular Weight (g/mol) | 216.22 |
| MDL Number | MFCD00002081 |
| SMILES | CP(=O)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | methyldiphenylphosphine oxide,methyl diphenyl phosphine oxide,diphenylmethylphosphine oxide,phosphine oxide, methyldiphenyl,phosphine oxide, diphenylmethyl,methyl-phenylphosphoryl benzene,methyl phenyl phosphoryl benzene,methyl phenyl phosphoroso benzene,methyldiphenylphosphineoxide |
| IUPAC Name | [methyl(phenyl)phosphoroso]benzene |
| InChI Key | PEGCITODQASXKH-UHFFFAOYSA-N |
| Molecular Formula | C13H13OP |
Methyl 3,5-Dibromo-4-hydroxybenzoate Monohydrate 99.0+%, TCI America™
CAS: 41727-47-3 Molecular Formula: C8H6Br2O3 Molecular Weight (g/mol): 309.941 MDL Number: MFCD00016416 InChI Key: NVGJGYZKXBLIKY-UHFFFAOYSA-N Synonym: 3,5-dibromo-4-hydroxybenzoic acid methyl ester,3,5-dibromo-4-hydroxy-benzoic acid methyl ester,methyl 3,5-bis bromanyl-4-oxidanyl-benzoate,acmc-20akhs,pubchem3978,methyl dibromosalicylate,rarechem al bf 0231,timtec-bb sbb012530,labotest-bb lt00455670,labotest-bb lt03332530 PubChem CID: 726975 IUPAC Name: methyl 3,5-dibromo-4-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C(=C1)Br)O)Br
| PubChem CID | 726975 |
|---|---|
| CAS | 41727-47-3 |
| Molecular Weight (g/mol) | 309.941 |
| MDL Number | MFCD00016416 |
| SMILES | COC(=O)C1=CC(=C(C(=C1)Br)O)Br |
| Synonym | 3,5-dibromo-4-hydroxybenzoic acid methyl ester,3,5-dibromo-4-hydroxy-benzoic acid methyl ester,methyl 3,5-bis bromanyl-4-oxidanyl-benzoate,acmc-20akhs,pubchem3978,methyl dibromosalicylate,rarechem al bf 0231,timtec-bb sbb012530,labotest-bb lt00455670,labotest-bb lt03332530 |
| IUPAC Name | methyl 3,5-dibromo-4-hydroxybenzoate |
| InChI Key | NVGJGYZKXBLIKY-UHFFFAOYSA-N |
| Molecular Formula | C8H6Br2O3 |
Diphenyliodonium Bromide 98.0+%, TCI America™
CAS: 1483-73-4 Molecular Formula: C12H10BrI Molecular Weight (g/mol): 361.02 MDL Number: MFCD00031703 InChI Key: LGPSGXJFQQZYMS-UHFFFAOYSA-M Synonym: diphenyliodonium bromide,iodonium, diphenyl-, bromide,diphenyliodanium bromide,iodonium, diphenyl-, bromide 1:1,diphenyliodoniumbromide,diphenyl iodonium bromide,acmc-1c252,iodonium, diphenyl-,bromide 1:1 PubChem CID: 73871 IUPAC Name: diphenyliodanium bromide SMILES: [Br-].[I+](C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 73871 |
|---|---|
| CAS | 1483-73-4 |
| Molecular Weight (g/mol) | 361.02 |
| MDL Number | MFCD00031703 |
| SMILES | [Br-].[I+](C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | diphenyliodonium bromide,iodonium, diphenyl-, bromide,diphenyliodanium bromide,iodonium, diphenyl-, bromide 1:1,diphenyliodoniumbromide,diphenyl iodonium bromide,acmc-1c252,iodonium, diphenyl-,bromide 1:1 |
| IUPAC Name | diphenyliodanium bromide |
| InChI Key | LGPSGXJFQQZYMS-UHFFFAOYSA-M |
| Molecular Formula | C12H10BrI |
Diphenyliodonium Nitrate, TCI America™
CAS: 722-56-5 Molecular Formula: C12H10INO3 Molecular Weight (g/mol): 343.12 MDL Number: MFCD00031704 InChI Key: CQZCVYWWRJDZBO-UHFFFAOYSA-N Synonym: diphenyliodonium nitrate,iodonium, diphenyl-, nitrate,diphenyliodanium nitrate,acmc-1belb PubChem CID: 12876 IUPAC Name: diphenyliodanium;nitrate SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[N+](=O)([O-])[O-]
| PubChem CID | 12876 |
|---|---|
| CAS | 722-56-5 |
| Molecular Weight (g/mol) | 343.12 |
| MDL Number | MFCD00031704 |
| SMILES | C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[N+](=O)([O-])[O-] |
| Synonym | diphenyliodonium nitrate,iodonium, diphenyl-, nitrate,diphenyliodanium nitrate,acmc-1belb |
| IUPAC Name | diphenyliodanium;nitrate |
| InChI Key | CQZCVYWWRJDZBO-UHFFFAOYSA-N |
| Molecular Formula | C12H10INO3 |
3,4-Dibromotoluene 98.0+%, TCI America™
CAS: 60956-23-2 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.933 MDL Number: MFCD00079744 InChI Key: LDCPXNOCWDGYIU-UHFFFAOYSA-N Synonym: 3,4-dibromotoluene,benzene, 1,2-dibromo-4-methyl,3,4 dibromo toluene,benzene,1,2-dibromo-4-methyl,3,4-dibromtoluol,3,4 dibromotoluene,pubchem3930,acmc-1b64t,ksc493e6j PubChem CID: 34679 IUPAC Name: 1,2-dibromo-4-methylbenzene SMILES: CC1=CC(=C(C=C1)Br)Br
| PubChem CID | 34679 |
|---|---|
| CAS | 60956-23-2 |
| Molecular Weight (g/mol) | 249.933 |
| MDL Number | MFCD00079744 |
| SMILES | CC1=CC(=C(C=C1)Br)Br |
| Synonym | 3,4-dibromotoluene,benzene, 1,2-dibromo-4-methyl,3,4 dibromo toluene,benzene,1,2-dibromo-4-methyl,3,4-dibromtoluol,3,4 dibromotoluene,pubchem3930,acmc-1b64t,ksc493e6j |
| IUPAC Name | 1,2-dibromo-4-methylbenzene |
| InChI Key | LDCPXNOCWDGYIU-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2 |
3,5-Difluorobenzaldehyde 98.0+%, TCI America™
CAS: 32085-88-4 Molecular Formula: C7H4F2O Molecular Weight (g/mol): 142.105 MDL Number: MFCD00010329 InChI Key: ASOFZHSTJHGQDT-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-difluoro,3,5-difluoro-benzaldehyde,pubchem1414,3,5difluorobenzaldehyde,acmc-1aewe,3,5-diflourobenzaldehyde,3-5-difluorobenzaldehyde,3, 5-difluorobenzaldehyde,ksc224o7p,3,5-difluorophenyl methanone PubChem CID: 588160 IUPAC Name: 3,5-difluorobenzaldehyde SMILES: C1=C(C=C(C=C1F)F)C=O
| PubChem CID | 588160 |
|---|---|
| CAS | 32085-88-4 |
| Molecular Weight (g/mol) | 142.105 |
| MDL Number | MFCD00010329 |
| SMILES | C1=C(C=C(C=C1F)F)C=O |
| Synonym | benzaldehyde, 3,5-difluoro,3,5-difluoro-benzaldehyde,pubchem1414,3,5difluorobenzaldehyde,acmc-1aewe,3,5-diflourobenzaldehyde,3-5-difluorobenzaldehyde,3, 5-difluorobenzaldehyde,ksc224o7p,3,5-difluorophenyl methanone |
| IUPAC Name | 3,5-difluorobenzaldehyde |
| InChI Key | ASOFZHSTJHGQDT-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O |
3,3-Diphenyl-1-propanol 98.0+%, TCI America™
CAS: 20017-67-8 Molecular Formula: C15H16O Molecular Weight (g/mol): 212.29 MDL Number: MFCD00002930 InChI Key: IDCXQMVSIIJUEH-UHFFFAOYSA-N PubChem CID: 29908 IUPAC Name: 3,3-diphenylpropan-1-ol SMILES: OCCC(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 29908 |
|---|---|
| CAS | 20017-67-8 |
| Molecular Weight (g/mol) | 212.29 |
| MDL Number | MFCD00002930 |
| SMILES | OCCC(C1=CC=CC=C1)C1=CC=CC=C1 |
| IUPAC Name | 3,3-diphenylpropan-1-ol |
| InChI Key | IDCXQMVSIIJUEH-UHFFFAOYSA-N |
| Molecular Formula | C15H16O |
2,3-Difluorophenylacetic Acid 98.0+%, TCI America™
CAS: 145689-41-4 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00040968 InChI Key: UXSQXUSJGPVOKT-UHFFFAOYSA-N Synonym: 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot PubChem CID: 520772 IUPAC Name: 2-(2,3-difluorophenyl)acetic acid SMILES: C1=CC(=C(C(=C1)F)F)CC(=O)O
| PubChem CID | 520772 |
|---|---|
| CAS | 145689-41-4 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD00040968 |
| SMILES | C1=CC(=C(C(=C1)F)F)CC(=O)O |
| Synonym | 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot |
| IUPAC Name | 2-(2,3-difluorophenyl)acetic acid |
| InChI Key | UXSQXUSJGPVOKT-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
4-alpha-Cumylphenol 98.0+%, TCI America™
CAS: 599-64-4 Molecular Formula: C15H16O Molecular Weight (g/mol): 212.292 MDL Number: MFCD00002365 InChI Key: QBDSZLJBMIMQRS-UHFFFAOYSA-N Synonym: 4-cumylphenol,p-cumylphenol,4-2-phenylpropan-2-yl phenol,p-cumyl phenol,phenol, 4-1-methyl-1-phenylethyl,4-1-methyl-1-phenylethyl phenol,4-alpha-cumylphenol,4-dimethylphenylmethyl phenol,4-hydroxydiphenyldimethylmethane,2-phenyl-2-4-hydroxyphenyl propane PubChem CID: 11742 ChEBI: CHEBI:35092 IUPAC Name: 4-(2-phenylpropan-2-yl)phenol SMILES: CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)O
| PubChem CID | 11742 |
|---|---|
| CAS | 599-64-4 |
| Molecular Weight (g/mol) | 212.292 |
| ChEBI | CHEBI:35092 |
| MDL Number | MFCD00002365 |
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)O |
| Synonym | 4-cumylphenol,p-cumylphenol,4-2-phenylpropan-2-yl phenol,p-cumyl phenol,phenol, 4-1-methyl-1-phenylethyl,4-1-methyl-1-phenylethyl phenol,4-alpha-cumylphenol,4-dimethylphenylmethyl phenol,4-hydroxydiphenyldimethylmethane,2-phenyl-2-4-hydroxyphenyl propane |
| IUPAC Name | 4-(2-phenylpropan-2-yl)phenol |
| InChI Key | QBDSZLJBMIMQRS-UHFFFAOYSA-N |
| Molecular Formula | C15H16O |
3-Cyanobenzoic Acid 98.0+%, TCI America™
CAS: 1877-72-1 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002486 InChI Key: GYLKKXHEIIFTJH-UHFFFAOYSA-N Synonym: m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid PubChem CID: 15875 IUPAC Name: 3-cyanobenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C#N
| PubChem CID | 15875 |
|---|---|
| CAS | 1877-72-1 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002486 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C#N |
| Synonym | m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid |
| IUPAC Name | 3-cyanobenzoic acid |
| InChI Key | GYLKKXHEIIFTJH-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
1,3-Dibromo-5-fluoro-2-iodobenzene 98.0+%, TCI America™
CAS: 62720-29-0 Molecular Formula: C6H2Br2FI Molecular Weight (g/mol): 379.79 MDL Number: MFCD00042232 InChI Key: LIWKANDEJFABTQ-UHFFFAOYSA-N Synonym: 2,6-dibromo-4-fluoroiodobenzene,benzene, 1,3-dibromo-5-fluoro-2-iodo,1,3-dibromo-5-fluoro-2-iodo-benzene,pubchem3449,acmc-1b2cd,ksc615o5d,2.6-dibromo-4-fluoro iodobenzene,2,6-dibromo-4-fluoro-1-iodobenzene,benzene,1,3-dibromo-5-fluoro-2-iodo PubChem CID: 2724606 IUPAC Name: 1,3-dibromo-5-fluoro-2-iodobenzene SMILES: FC1=CC(Br)=C(I)C(Br)=C1
| PubChem CID | 2724606 |
|---|---|
| CAS | 62720-29-0 |
| Molecular Weight (g/mol) | 379.79 |
| MDL Number | MFCD00042232 |
| SMILES | FC1=CC(Br)=C(I)C(Br)=C1 |
| Synonym | 2,6-dibromo-4-fluoroiodobenzene,benzene, 1,3-dibromo-5-fluoro-2-iodo,1,3-dibromo-5-fluoro-2-iodo-benzene,pubchem3449,acmc-1b2cd,ksc615o5d,2.6-dibromo-4-fluoro iodobenzene,2,6-dibromo-4-fluoro-1-iodobenzene,benzene,1,3-dibromo-5-fluoro-2-iodo |
| IUPAC Name | 1,3-dibromo-5-fluoro-2-iodobenzene |
| InChI Key | LIWKANDEJFABTQ-UHFFFAOYSA-N |
| Molecular Formula | C6H2Br2FI |