Benzene and substituted derivatives
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4-Benzylresorcinol 97.0+%, TCI America™
CAS: 2284-30-2 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00059620 InChI Key: QVFIWTNWKHFVEH-UHFFFAOYSA-N PubChem CID: 75294 IUPAC Name: 4-benzylbenzene-1,3-diol SMILES: C1=CC=C(C=C1)CC2=C(C=C(C=C2)O)O
| PubChem CID | 75294 |
|---|---|
| CAS | 2284-30-2 |
| Molecular Weight (g/mol) | 200.237 |
| MDL Number | MFCD00059620 |
| SMILES | C1=CC=C(C=C1)CC2=C(C=C(C=C2)O)O |
| IUPAC Name | 4-benzylbenzene-1,3-diol |
| InChI Key | QVFIWTNWKHFVEH-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
4-Bromo-2,2-diphenylbutyronitrile 95.0+%, TCI America™
CAS: 39186-58-8 Molecular Formula: C16H14BrN Molecular Weight (g/mol): 300.199 MDL Number: MFCD00001845 InChI Key: IGYSFJHVFHNOEI-UHFFFAOYSA-N Synonym: 4-bromo-2,2-diphenylbutyronitrile,2,2-diphenyl-4-bromobutyronitrile,4-bromo-2,2-diphenyl-butyronitrile,3-cyano-3,3-diphenylpropyl bromide,benzeneacetonitrile, .alpha.-2-bromoethyl-.alpha.-phenyl,acmc-1csza,butyronitrile,2-diphenyl,ksc495i2r,aronis25014,bromoethyl diphenyl acetonitrile PubChem CID: 96575 IUPAC Name: 4-bromo-2,2-diphenylbutanenitrile SMILES: C1=CC=C(C=C1)C(CCBr)(C#N)C2=CC=CC=C2
| PubChem CID | 96575 |
|---|---|
| CAS | 39186-58-8 |
| Molecular Weight (g/mol) | 300.199 |
| MDL Number | MFCD00001845 |
| SMILES | C1=CC=C(C=C1)C(CCBr)(C#N)C2=CC=CC=C2 |
| Synonym | 4-bromo-2,2-diphenylbutyronitrile,2,2-diphenyl-4-bromobutyronitrile,4-bromo-2,2-diphenyl-butyronitrile,3-cyano-3,3-diphenylpropyl bromide,benzeneacetonitrile, .alpha.-2-bromoethyl-.alpha.-phenyl,acmc-1csza,butyronitrile,2-diphenyl,ksc495i2r,aronis25014,bromoethyl diphenyl acetonitrile |
| IUPAC Name | 4-bromo-2,2-diphenylbutanenitrile |
| InChI Key | IGYSFJHVFHNOEI-UHFFFAOYSA-N |
| Molecular Formula | C16H14BrN |
2,2-Bis(4-carboxyphenyl)hexafluoropropane 98.0+%, TCI America™
CAS: 1171-47-7 Molecular Formula: C17H10F6O4 Molecular Weight (g/mol): 392.253 MDL Number: MFCD00040931 InChI Key: PHQYMDAUTAXXFZ-UHFFFAOYSA-N Synonym: 2,2-bis 4-carboxyphenyl hexafluoropropane,4,4'-perfluoropropane-2,2-diyl dibenzoic acid,benzoic acid, 4,4'-2,2,2-trifluoro-1-trifluoromethyl ethylidene bis,4-2-4-carboxyphenyl-1,1,1,3,3,3-hexafluoropropan-2-yl benzoic acid,4,4'-hexafluoroisopropylidene bis benzoic acid,4-1-4-carboxyphenyl-2,2,2-trifluoro-1-trifluoromethyl ethyl benzoic acid,acmc-1c1gj,2,2-bis-4-carboxyphenyl hexafluoropropane PubChem CID: 633763 IUPAC Name: 4-[2-(4-carboxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)C(C2=CC=C(C=C2)C(=O)O)(C(F)(F)F)C(F)(F)F
| PubChem CID | 633763 |
|---|---|
| CAS | 1171-47-7 |
| Molecular Weight (g/mol) | 392.253 |
| MDL Number | MFCD00040931 |
| SMILES | C1=CC(=CC=C1C(=O)O)C(C2=CC=C(C=C2)C(=O)O)(C(F)(F)F)C(F)(F)F |
| Synonym | 2,2-bis 4-carboxyphenyl hexafluoropropane,4,4'-perfluoropropane-2,2-diyl dibenzoic acid,benzoic acid, 4,4'-2,2,2-trifluoro-1-trifluoromethyl ethylidene bis,4-2-4-carboxyphenyl-1,1,1,3,3,3-hexafluoropropan-2-yl benzoic acid,4,4'-hexafluoroisopropylidene bis benzoic acid,4-1-4-carboxyphenyl-2,2,2-trifluoro-1-trifluoromethyl ethyl benzoic acid,acmc-1c1gj,2,2-bis-4-carboxyphenyl hexafluoropropane |
| IUPAC Name | 4-[2-(4-carboxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid |
| InChI Key | PHQYMDAUTAXXFZ-UHFFFAOYSA-N |
| Molecular Formula | C17H10F6O4 |
2-Bromobenzamide 98.0+%, TCI America™
CAS: 4001-73-4 Molecular Formula: C7H6BrNO Molecular Weight (g/mol): 200.035 MDL Number: MFCD00007969 InChI Key: NHNAEZDWNCRWRW-UHFFFAOYSA-N Synonym: benzamide, 2-bromo,o-bromobenzamide,benzamide, o-bromo,2-bromo-benzamide,2-bromobenzamide,bromobenzamide,pubchem3733,maybridge1_005867,acmc-209j9x PubChem CID: 77616 IUPAC Name: 2-bromobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)Br
| PubChem CID | 77616 |
|---|---|
| CAS | 4001-73-4 |
| Molecular Weight (g/mol) | 200.035 |
| MDL Number | MFCD00007969 |
| SMILES | C1=CC=C(C(=C1)C(=O)N)Br |
| Synonym | benzamide, 2-bromo,o-bromobenzamide,benzamide, o-bromo,2-bromo-benzamide,2-bromobenzamide,bromobenzamide,pubchem3733,maybridge1_005867,acmc-209j9x |
| IUPAC Name | 2-bromobenzamide |
| InChI Key | NHNAEZDWNCRWRW-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO |
3-Bromo-4-fluorophenylacetic Acid 97.0+%, TCI America™
CAS: 194019-11-9 Molecular Formula: C8H6BrFO2 Molecular Weight (g/mol): 233.04 MDL Number: MFCD04038373 InChI Key: XXFGIJYSXNXNAU-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorophenylacetic acid,2-3-bromo-4-fluorophenyl acetic acid,3-bromo-4-fluorophenylaceticacid,3-bromo-4-fluorophenyl acetic acid,benzeneacetic acid, 3-bromo-4-fluoro,3-bromo-4-fluoro-phenyl-acetic acid,2-3-bromo-4-fluoro-phenyl acetic acid,acmc-209exn,ksc497i4b,61150-59-2 3-bromo-4-fluorophenylacetic acid PubChem CID: 3416339 IUPAC Name: 2-(3-bromo-4-fluorophenyl)acetic acid SMILES: OC(=O)CC1=CC(Br)=C(F)C=C1
| PubChem CID | 3416339 |
|---|---|
| CAS | 194019-11-9 |
| Molecular Weight (g/mol) | 233.04 |
| MDL Number | MFCD04038373 |
| SMILES | OC(=O)CC1=CC(Br)=C(F)C=C1 |
| Synonym | 3-bromo-4-fluorophenylacetic acid,2-3-bromo-4-fluorophenyl acetic acid,3-bromo-4-fluorophenylaceticacid,3-bromo-4-fluorophenyl acetic acid,benzeneacetic acid, 3-bromo-4-fluoro,3-bromo-4-fluoro-phenyl-acetic acid,2-3-bromo-4-fluoro-phenyl acetic acid,acmc-209exn,ksc497i4b,61150-59-2 3-bromo-4-fluorophenylacetic acid |
| IUPAC Name | 2-(3-bromo-4-fluorophenyl)acetic acid |
| InChI Key | XXFGIJYSXNXNAU-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrFO2 |
3-Bromo-4-fluoroaniline 97.0+%, TCI America™
CAS: 656-64-4 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.015 MDL Number: MFCD03788559 InChI Key: KOWPUNQBGWIERF-UHFFFAOYSA-N Synonym: 3-bromo-4-fluoro aniline,benzenamine, 3-bromo-4-fluoro,3-bromo-4-fluorobenzenamine,3-bromo-4-fluorophenylamine,3-bromo-4-fluoro-aniline,3-bromo-4-fluoro-phenylamine,pubchem2924,acmc-209nrn,3-bromo-4-fluoraniline,3-bromo 4-fluoro-aniline PubChem CID: 2779286 IUPAC Name: 3-bromo-4-fluoroaniline SMILES: C1=CC(=C(C=C1N)Br)F
| PubChem CID | 2779286 |
|---|---|
| CAS | 656-64-4 |
| Molecular Weight (g/mol) | 190.015 |
| MDL Number | MFCD03788559 |
| SMILES | C1=CC(=C(C=C1N)Br)F |
| Synonym | 3-bromo-4-fluoro aniline,benzenamine, 3-bromo-4-fluoro,3-bromo-4-fluorobenzenamine,3-bromo-4-fluorophenylamine,3-bromo-4-fluoro-aniline,3-bromo-4-fluoro-phenylamine,pubchem2924,acmc-209nrn,3-bromo-4-fluoraniline,3-bromo 4-fluoro-aniline |
| IUPAC Name | 3-bromo-4-fluoroaniline |
| InChI Key | KOWPUNQBGWIERF-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrFN |
4-Bromo-beta,beta-difluorostyrene (stabilized with TBC) 98.0+%, TCI America™
CAS: 84750-93-6 Molecular Formula: C8H5BrF2 Molecular Weight (g/mol): 219.029 InChI Key: LXJISEJYMAHRKE-UHFFFAOYSA-N Synonym: 1-Bromo-4-(2,2-difluorovinyl)benzene, 2-(4-Bromophenyl)-1,1-difluoroethylene PubChem CID: 22913822 IUPAC Name: 1-bromo-4-(2,2-difluoroethenyl)benzene SMILES: C1=CC(=CC=C1C=C(F)F)Br
| PubChem CID | 22913822 |
|---|---|
| CAS | 84750-93-6 |
| Molecular Weight (g/mol) | 219.029 |
| SMILES | C1=CC(=CC=C1C=C(F)F)Br |
| Synonym | 1-Bromo-4-(2,2-difluorovinyl)benzene, 2-(4-Bromophenyl)-1,1-difluoroethylene |
| IUPAC Name | 1-bromo-4-(2,2-difluoroethenyl)benzene |
| InChI Key | LXJISEJYMAHRKE-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrF2 |
Benzhydrylamine 97.0+%, TCI America™
CAS: 91-00-9 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.254 MDL Number: MFCD00008059 InChI Key: MGHPNCMVUAKAIE-UHFFFAOYSA-N Synonym: aminodiphenylmethane,benzhydrylamine,1,1-diphenylmethylamine,diphenylmethyl amine,1,1-diphenylmethanamine,alpha-aminodiphenylmethane,methanamine, 1,1-diphenyl,alpha-phenylbenzylamine,benzhydrylamin,benzhydryl amine PubChem CID: 7036 IUPAC Name: diphenylmethanamine SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)N
| PubChem CID | 7036 |
|---|---|
| CAS | 91-00-9 |
| Molecular Weight (g/mol) | 183.254 |
| MDL Number | MFCD00008059 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)N |
| Synonym | aminodiphenylmethane,benzhydrylamine,1,1-diphenylmethylamine,diphenylmethyl amine,1,1-diphenylmethanamine,alpha-aminodiphenylmethane,methanamine, 1,1-diphenyl,alpha-phenylbenzylamine,benzhydrylamin,benzhydryl amine |
| IUPAC Name | diphenylmethanamine |
| InChI Key | MGHPNCMVUAKAIE-UHFFFAOYSA-N |
| Molecular Formula | C13H13N |
Benzyltriethylammonium Bromide 98.0+%, TCI America™
CAS: 5197-95-5 Molecular Formula: C13H22BrN Molecular Weight (g/mol): 272.23 MDL Number: MFCD00011822 InChI Key: CHQVQXZFZHACQQ-UHFFFAOYSA-M Synonym: benzyltriethylammonium bromide,n-benzyl-n,n-diethylethanaminium bromide,benzyl triethyl ammonium bromide,triethylbenzylammonium bromide,bteab,benzenemethanaminium, n,n,n-triethyl-, bromide,benzyltriethyl ammonium bromide,n-benzyl-n,n,n-triethylammoniumbromide,benzyltriethylazanium bromide,pubchem7797 PubChem CID: 165294 IUPAC Name: benzyltriethylazanium bromide SMILES: [Br-].CC[N+](CC)(CC)CC1=CC=CC=C1
| PubChem CID | 165294 |
|---|---|
| CAS | 5197-95-5 |
| Molecular Weight (g/mol) | 272.23 |
| MDL Number | MFCD00011822 |
| SMILES | [Br-].CC[N+](CC)(CC)CC1=CC=CC=C1 |
| Synonym | benzyltriethylammonium bromide,n-benzyl-n,n-diethylethanaminium bromide,benzyl triethyl ammonium bromide,triethylbenzylammonium bromide,bteab,benzenemethanaminium, n,n,n-triethyl-, bromide,benzyltriethyl ammonium bromide,n-benzyl-n,n,n-triethylammoniumbromide,benzyltriethylazanium bromide,pubchem7797 |
| IUPAC Name | benzyltriethylazanium bromide |
| InChI Key | CHQVQXZFZHACQQ-UHFFFAOYSA-M |
| Molecular Formula | C13H22BrN |
2-Bromoaniline 98.0+%, TCI America™
CAS: 615-36-1 Molecular Formula: C6H6BrN Molecular Weight (g/mol): 172.025 MDL Number: MFCD00007632 InChI Key: AOPBDRUWRLBSDB-UHFFFAOYSA-N Synonym: o-bromoaniline,benzenamine, 2-bromo,o-aminobromobenzene,aniline, o-bromo,2-bromobenzenamine,bromoaniline 2-,2-bromo aniline,2-bromophenylamine,benzenamine,2-bromo,2-bromioaniline PubChem CID: 11992 IUPAC Name: 2-bromoaniline SMILES: C1=CC=C(C(=C1)N)Br
| PubChem CID | 11992 |
|---|---|
| CAS | 615-36-1 |
| Molecular Weight (g/mol) | 172.025 |
| MDL Number | MFCD00007632 |
| SMILES | C1=CC=C(C(=C1)N)Br |
| Synonym | o-bromoaniline,benzenamine, 2-bromo,o-aminobromobenzene,aniline, o-bromo,2-bromobenzenamine,bromoaniline 2-,2-bromo aniline,2-bromophenylamine,benzenamine,2-bromo,2-bromioaniline |
| IUPAC Name | 2-bromoaniline |
| InChI Key | AOPBDRUWRLBSDB-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrN |
Benzoyl Cyanide 98.0+%, TCI America™
CAS: 613-90-1 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.134 MDL Number: MFCD00001837 InChI Key: GJQBHOAJJGIPRH-UHFFFAOYSA-N Synonym: phenylglyoxylonitrile,benzoyl nitrile,benzoylcyanide,oxo phenyl acetonitrile,alpha-oxobenzeneacetonitrile,benzeneacetonitrile, .alpha.-oxo,glyoxylonitrile, phenyl,alpha-oxo-alpha-tolunitrile,2-oxo-2-phenylethanenitrile,alpha-tolunitrile, alpha-oxo PubChem CID: 11953 ChEBI: CHEBI:51853 IUPAC Name: benzoyl cyanide SMILES: C1=CC=C(C=C1)C(=O)C#N
| PubChem CID | 11953 |
|---|---|
| CAS | 613-90-1 |
| Molecular Weight (g/mol) | 131.134 |
| ChEBI | CHEBI:51853 |
| MDL Number | MFCD00001837 |
| SMILES | C1=CC=C(C=C1)C(=O)C#N |
| Synonym | phenylglyoxylonitrile,benzoyl nitrile,benzoylcyanide,oxo phenyl acetonitrile,alpha-oxobenzeneacetonitrile,benzeneacetonitrile, .alpha.-oxo,glyoxylonitrile, phenyl,alpha-oxo-alpha-tolunitrile,2-oxo-2-phenylethanenitrile,alpha-tolunitrile, alpha-oxo |
| IUPAC Name | benzoyl cyanide |
| InChI Key | GJQBHOAJJGIPRH-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO |
2-Bromobenzoic Acid 98.0+%, TCI America™
CAS: 88-65-3 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD00002402 InChI Key: XRXMNWGCKISMOH-UHFFFAOYSA-N Synonym: o-bromobenzoic acid,benzoic acid, 2-bromo,bromobenzoic acid,benzoic acid, o-bromo,2-bromo-benzoic acid,benzoic acid, bromo,unii-az789tzs4l,az789tzs4l,ortho-bromobenzoic acid,attercop-chm at111657 PubChem CID: 6940 IUPAC Name: 2-bromobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Br
| PubChem CID | 6940 |
|---|---|
| CAS | 88-65-3 |
| Molecular Weight (g/mol) | 201.019 |
| MDL Number | MFCD00002402 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)Br |
| Synonym | o-bromobenzoic acid,benzoic acid, 2-bromo,bromobenzoic acid,benzoic acid, o-bromo,2-bromo-benzoic acid,benzoic acid, bromo,unii-az789tzs4l,az789tzs4l,ortho-bromobenzoic acid,attercop-chm at111657 |
| IUPAC Name | 2-bromobenzoic acid |
| InChI Key | XRXMNWGCKISMOH-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
2,2-Bis(4-chloroformyloxyphenyl)propane 97.0+%, TCI America™
CAS: 2024-88-6 Molecular Formula: C17H14Cl2O4 Molecular Weight (g/mol): 353.20 MDL Number: MFCD00060109 InChI Key: MMWCQWOKHLEYSP-UHFFFAOYSA-N Synonym: bisphenol a bis chloroformate,2,2-bis 4-chloroformyloxyphenyl propane,bisphenol a dichloroformate,carbonochloridic acid, 1-methylethylidene di-4,1-phenylene ester,2,2-bis p-chloroformyloxy phenyl propane,carbonochloridic acid, c,c'-1-methylethylidene di-4,1-phenylene ester,isopropylidenedi-p-phenylene bis chloroformate,bisphenol a bischloroformate,bidd:er0407 PubChem CID: 74843 ChEBI: CHEBI:34576 IUPAC Name: 4-(2-{4-[(chlorocarbonyl)oxy]phenyl}propan-2-yl)phenyl carbonochloridate SMILES: CC(C)(C1=CC=C(OC(Cl)=O)C=C1)C1=CC=C(OC(Cl)=O)C=C1
| PubChem CID | 74843 |
|---|---|
| CAS | 2024-88-6 |
| Molecular Weight (g/mol) | 353.20 |
| ChEBI | CHEBI:34576 |
| MDL Number | MFCD00060109 |
| SMILES | CC(C)(C1=CC=C(OC(Cl)=O)C=C1)C1=CC=C(OC(Cl)=O)C=C1 |
| Synonym | bisphenol a bis chloroformate,2,2-bis 4-chloroformyloxyphenyl propane,bisphenol a dichloroformate,carbonochloridic acid, 1-methylethylidene di-4,1-phenylene ester,2,2-bis p-chloroformyloxy phenyl propane,carbonochloridic acid, c,c'-1-methylethylidene di-4,1-phenylene ester,isopropylidenedi-p-phenylene bis chloroformate,bisphenol a bischloroformate,bidd:er0407 |
| IUPAC Name | 4-(2-{4-[(chlorocarbonyl)oxy]phenyl}propan-2-yl)phenyl carbonochloridate |
| InChI Key | MMWCQWOKHLEYSP-UHFFFAOYSA-N |
| Molecular Formula | C17H14Cl2O4 |
1-Bromo-3-iodobenzene (stabilized with Copper chip) 97.0+%, TCI America™
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 |
1-Bromo-2-ethylbenzene 98.0+%, TCI America™
CAS: 1973-22-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000077 InChI Key: HVRUGFJYCAFAAN-UHFFFAOYSA-N PubChem CID: 16089 IUPAC Name: 1-bromo-2-ethylbenzene SMILES: CCC1=CC=CC=C1Br
| PubChem CID | 16089 |
|---|---|
| CAS | 1973-22-4 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000077 |
| SMILES | CCC1=CC=CC=C1Br |
| IUPAC Name | 1-bromo-2-ethylbenzene |
| InChI Key | HVRUGFJYCAFAAN-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |