Benzenoids
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1,3-Bis(2-isocyanato-2-propyl)benzene 97.0+%, TCI America™
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CAS: 2778-42-9 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00142493 InChI Key: AZYRZNIYJDKRHO-UHFFFAOYSA-N Synonym: 1,3-Bis(1-isocyanato-1-methylethyl)benzene PubChem CID: 17719 IUPAC Name: 1,3-bis(2-isocyanatopropan-2-yl)benzene SMILES: CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O
| PubChem CID | 17719 |
|---|---|
| CAS | 2778-42-9 |
| Molecular Weight (g/mol) | 244.294 |
| MDL Number | MFCD00142493 |
| SMILES | CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O |
| Synonym | 1,3-Bis(1-isocyanato-1-methylethyl)benzene |
| IUPAC Name | 1,3-bis(2-isocyanatopropan-2-yl)benzene |
| InChI Key | AZYRZNIYJDKRHO-UHFFFAOYSA-N |
| Molecular Formula | C14H16N2O2 |
2,2-Bis(4-cyanatophenyl)propane 98.0+%, TCI America™
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CAS: 1156-51-0 Molecular Formula: C17H14N2O2 Molecular Weight (g/mol): 278.311 MDL Number: MFCD00037423 InChI Key: AHZMUXQJTGRNHT-UHFFFAOYSA-N Synonym: Bisphenol A Dicyanate, 4,4′C-Isopropylidenebis(cyanatobenzene) PubChem CID: 70872 IUPAC Name: [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate SMILES: CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N
| PubChem CID | 70872 |
|---|---|
| CAS | 1156-51-0 |
| Molecular Weight (g/mol) | 278.311 |
| MDL Number | MFCD00037423 |
| SMILES | CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N |
| Synonym | Bisphenol A Dicyanate, 4,4′C-Isopropylidenebis(cyanatobenzene) |
| IUPAC Name | [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate |
| InChI Key | AHZMUXQJTGRNHT-UHFFFAOYSA-N |
| Molecular Formula | C17H14N2O2 |
2-Bromo-1-phenylpropane 93.0+%, TCI America™
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4-Benzyloxy-3-methoxybenzaldehyde 98.0+%, TCI America™
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CAS: 2426-87-1 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD00003365 InChI Key: JSHLOPGSDZTEGQ-UHFFFAOYSA-N Synonym: 4-benzyloxy-3-methoxybenzaldehyde,benzylvanillin,o-benzylvanillin,vanillin benzyl ether,unii-5knc2tsw9g,4-benzyloxy-3-methoxy-benzaldehyde,benzaldehyde, 3-methoxy-4-phenylmethoxy,5knc2tsw9g,3-methoxy-4-phenylmethoxy benzaldehyde PubChem CID: 75506 IUPAC Name: 4-(benzyloxy)-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1OCC1=CC=CC=C1
| PubChem CID | 75506 |
|---|---|
| CAS | 2426-87-1 |
| Molecular Weight (g/mol) | 242.27 |
| MDL Number | MFCD00003365 |
| SMILES | COC1=CC(C=O)=CC=C1OCC1=CC=CC=C1 |
| Synonym | 4-benzyloxy-3-methoxybenzaldehyde,benzylvanillin,o-benzylvanillin,vanillin benzyl ether,unii-5knc2tsw9g,4-benzyloxy-3-methoxy-benzaldehyde,benzaldehyde, 3-methoxy-4-phenylmethoxy,5knc2tsw9g,3-methoxy-4-phenylmethoxy benzaldehyde |
| IUPAC Name | 4-(benzyloxy)-3-methoxybenzaldehyde |
| InChI Key | JSHLOPGSDZTEGQ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O3 |
Bis(4-hydroxyphenyl) Disulfide 98.0+%, TCI America™
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CAS: 15015-57-3 Molecular Formula: C12H10O2S2 Molecular Weight (g/mol): 250.33 MDL Number: MFCD00020164 InChI Key: XGKGITBBMXTKTE-UHFFFAOYSA-N PubChem CID: 280665 IUPAC Name: 4-[(4-hydroxyphenyl)disulfanyl]phenol SMILES: C1=CC(=CC=C1O)SSC2=CC=C(C=C2)O
| PubChem CID | 280665 |
|---|---|
| CAS | 15015-57-3 |
| Molecular Weight (g/mol) | 250.33 |
| MDL Number | MFCD00020164 |
| SMILES | C1=CC(=CC=C1O)SSC2=CC=C(C=C2)O |
| IUPAC Name | 4-[(4-hydroxyphenyl)disulfanyl]phenol |
| InChI Key | XGKGITBBMXTKTE-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2S2 |
2-Bromophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 244205-40-1 Molecular Formula: C6H6BBrO2 Molecular Weight (g/mol): 200.83 MDL Number: MFCD01114672 InChI Key: PLVCYMZAEQRYHJ-UHFFFAOYSA-N Synonym: 2-bromophenyl boronic acid,o-bromophenylboronic acid,2-bromobenzeneboronic acid,2-bromophenylboronicacid,boronic acid, 2-bromophenyl,bromobenzeneboronic acid,pubchem13095,2-bromo phenyl boronic acid,2-bromo-phenyl boronic acid PubChem CID: 2773294 IUPAC Name: (2-bromophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1Br
| PubChem CID | 2773294 |
|---|---|
| CAS | 244205-40-1 |
| Molecular Weight (g/mol) | 200.83 |
| MDL Number | MFCD01114672 |
| SMILES | OB(O)C1=CC=CC=C1Br |
| Synonym | 2-bromophenyl boronic acid,o-bromophenylboronic acid,2-bromobenzeneboronic acid,2-bromophenylboronicacid,boronic acid, 2-bromophenyl,bromobenzeneboronic acid,pubchem13095,2-bromo phenyl boronic acid,2-bromo-phenyl boronic acid |
| IUPAC Name | (2-bromophenyl)boronic acid |
| InChI Key | PLVCYMZAEQRYHJ-UHFFFAOYSA-N |
| Molecular Formula | C6H6BBrO2 |
Bis(4-iodophenyl)amine 98.0+%, TCI America™
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CAS: 20255-70-3 Molecular Formula: C12H9I2N Molecular Weight (g/mol): 421.02 InChI Key: SJLIWXXAQHNDHM-UHFFFAOYSA-N PubChem CID: 12950430 IUPAC Name: 4-iodo-N-(4-iodophenyl)aniline SMILES: C1=CC(=CC=C1NC2=CC=C(C=C2)I)I
| PubChem CID | 12950430 |
|---|---|
| CAS | 20255-70-3 |
| Molecular Weight (g/mol) | 421.02 |
| SMILES | C1=CC(=CC=C1NC2=CC=C(C=C2)I)I |
| IUPAC Name | 4-iodo-N-(4-iodophenyl)aniline |
| InChI Key | SJLIWXXAQHNDHM-UHFFFAOYSA-N |
| Molecular Formula | C12H9I2N |
1,2-Bis[bis(pentafluorophenyl)phosphino]ethane 97.0+%, TCI America™
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CAS: 76858-94-1 Molecular Formula: C26H4F20P2 Molecular Weight (g/mol): 758.23 MDL Number: MFCD00058841 InChI Key: IGLFIYOFKVGEBP-UHFFFAOYSA-N Synonym: 1,2-bis dipentafluorophenylphosphino ethane,1,2-bis bis pentafluorophenyl phosphino ethane,1,2-bis bis perfluorophenyl phosphino ethane,2-bis 2,3,4,5,6-pentafluorophenyl phosphanylethyl-bis 2,3,4,5,6-pentafluorophenyl phosphane,ethane-1,2-diylbis bis pentafluorophenyl phosphane,dfppe,pubchem6546,acmc-209p6f,ethylenebis bis pentafluorophenyl phosphine,bis dipentafluorophenylphosphine ethane PubChem CID: 2734566 IUPAC Name: {2-[bis(2,3,4,5,6-pentafluorophenyl)phosphanyl]ethyl}bis(2,3,4,5,6-pentafluorophenyl)phosphane SMILES: FC1=C(F)C(F)=C(P(CCP(C2=C(F)C(F)=C(F)C(F)=C2F)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 | 2734566 |
|---|---|
| CAS | 76858-94-1 |
| Molecular Weight (g/mol) | 758.23 |
| MDL Number | MFCD00058841 |
| SMILES | FC1=C(F)C(F)=C(P(CCP(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F |
| Synonym | 1,2-bis dipentafluorophenylphosphino ethane,1,2-bis bis pentafluorophenyl phosphino ethane,1,2-bis bis perfluorophenyl phosphino ethane,2-bis 2,3,4,5,6-pentafluorophenyl phosphanylethyl-bis 2,3,4,5,6-pentafluorophenyl phosphane,ethane-1,2-diylbis bis pentafluorophenyl phosphane,dfppe,pubchem6546,acmc-209p6f,ethylenebis bis pentafluorophenyl phosphine,bis dipentafluorophenylphosphine ethane |
| IUPAC Name | {2-[bis(2,3,4,5,6-pentafluorophenyl)phosphanyl]ethyl}bis(2,3,4,5,6-pentafluorophenyl)phosphane |
| InChI Key | IGLFIYOFKVGEBP-UHFFFAOYSA-N |
| Molecular Formula | C26H4F20P2 |
5-Bromo-2-fluorophenol 98.0+%, TCI America™
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CAS: 112204-58-7 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD07782066 InChI Key: YPTHSYKJDRMAJY-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromophenol,phenol, 5-bromo-2-fluoro,2-fluoro-5-bromo phenol,5-bromo-2-fluoro-phenol,3-bromo-6-fluorophenol,3-bromo-6-fluoro-phenol,acmc-2099dd,ksc493i2d PubChem CID: 183421 IUPAC Name: 5-bromo-2-fluorophenol SMILES: C1=CC(=C(C=C1Br)O)F
| PubChem CID | 183421 |
|---|---|
| CAS | 112204-58-7 |
| Molecular Weight (g/mol) | 190.999 |
| MDL Number | MFCD07782066 |
| SMILES | C1=CC(=C(C=C1Br)O)F |
| Synonym | 2-fluoro-5-bromophenol,phenol, 5-bromo-2-fluoro,2-fluoro-5-bromo phenol,5-bromo-2-fluoro-phenol,3-bromo-6-fluorophenol,3-bromo-6-fluoro-phenol,acmc-2099dd,ksc493i2d |
| IUPAC Name | 5-bromo-2-fluorophenol |
| InChI Key | YPTHSYKJDRMAJY-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrFO |
2-Bromo-9,9'-spirobi[9H-fluorene] 98.0+%, TCI America™
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CAS: 171408-76-7 Molecular Formula: C25H15Br Molecular Weight (g/mol): 395.30 MDL Number: MFCD08704217 InChI Key: ONCCVJKFWKAZAE-UHFFFAOYSA-N PubChem CID: 15287522 IUPAC Name: 7-bromo-9,9'-spirobi[fluorene] SMILES: BrC1=CC2=C(C=C1)C1=CC=CC=C1C21C2=CC=CC=C2C2=CC=CC=C12
| PubChem CID | 15287522 |
|---|---|
| CAS | 171408-76-7 |
| Molecular Weight (g/mol) | 395.30 |
| MDL Number | MFCD08704217 |
| SMILES | BrC1=CC2=C(C=C1)C1=CC=CC=C1C21C2=CC=CC=C2C2=CC=CC=C12 |
| IUPAC Name | 7-bromo-9,9'-spirobi[fluorene] |
| InChI Key | ONCCVJKFWKAZAE-UHFFFAOYSA-N |
| Molecular Formula | C25H15Br |
Benzyltrimethylammonium Bromide 98.0+%, TCI America™
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CAS: 5350-41-4 Molecular Formula: C10H16BrN Molecular Weight (g/mol): 230.149 MDL Number: MFCD00011780 InChI Key: UUZYBYIOAZTMGC-UHFFFAOYSA-M Synonym: benzyltrimethylammonium bromide,n,n,n-trimethyl-1-phenylmethanaminium bromide,trimethylbenzylammonium bromide,n-benzyl-n,n,n-trimethylammonium bromide,wv 562 german,benzenemethanaminium, n,n,n-trimethyl-, bromide,nsc 24,ammonium, benzyltrimethyl-, bromide,benzyltrimethylammonium bromide btm PubChem CID: 21449 IUPAC Name: benzyl(trimethyl)azanium;bromide SMILES: C[N+](C)(C)CC1=CC=CC=C1.[Br-]
| PubChem CID | 21449 |
|---|---|
| CAS | 5350-41-4 |
| Molecular Weight (g/mol) | 230.149 |
| MDL Number | MFCD00011780 |
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.[Br-] |
| Synonym | benzyltrimethylammonium bromide,n,n,n-trimethyl-1-phenylmethanaminium bromide,trimethylbenzylammonium bromide,n-benzyl-n,n,n-trimethylammonium bromide,wv 562 german,benzenemethanaminium, n,n,n-trimethyl-, bromide,nsc 24,ammonium, benzyltrimethyl-, bromide,benzyltrimethylammonium bromide btm |
| IUPAC Name | benzyl(trimethyl)azanium;bromide |
| InChI Key | UUZYBYIOAZTMGC-UHFFFAOYSA-M |
| Molecular Formula | C10H16BrN |
1-Bromo-3-fluoro-2-nitrobenzene 98.0+%, TCI America™
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CAS: 886762-70-5 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 220.00 MDL Number: MFCD07368788 InChI Key: VFPAOFBPEYCAAZ-UHFFFAOYSA-N PubChem CID: 2783152 IUPAC Name: 1-bromo-3-fluoro-2-nitrobenzene SMILES: [O-][N+](=O)C1=C(F)C=CC=C1Br
| PubChem CID | 2783152 |
|---|---|
| CAS | 886762-70-5 |
| Molecular Weight (g/mol) | 220.00 |
| MDL Number | MFCD07368788 |
| SMILES | [O-][N+](=O)C1=C(F)C=CC=C1Br |
| IUPAC Name | 1-bromo-3-fluoro-2-nitrobenzene |
| InChI Key | VFPAOFBPEYCAAZ-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFNO2 |
4-Benzyloxybenzophenone 98.0+%, TCI America™
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CAS: 54589-41-2 Molecular Formula: C20H16O2 Molecular Weight (g/mol): 288.346 MDL Number: MFCD00017508 InChI Key: NMPNTBQOLRXPGK-UHFFFAOYSA-N Synonym: 4-benzyloxybenzophenone,4-benzyloxy benzophenone,4-benzyloxy phenyl phenyl methanone,phenyl-4-phenylmethoxyphenyl methanone,phenyl 4-phenylmethoxy phenyl ketone,acmc-20amoo,4-benzyl-oxybenzophenone,4-benzyloxyphenyl-phenyl-methanone PubChem CID: 458193 IUPAC Name: phenyl-(4-phenylmethoxyphenyl)methanone SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3
| PubChem CID | 458193 |
|---|---|
| CAS | 54589-41-2 |
| Molecular Weight (g/mol) | 288.346 |
| MDL Number | MFCD00017508 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3 |
| Synonym | 4-benzyloxybenzophenone,4-benzyloxy benzophenone,4-benzyloxy phenyl phenyl methanone,phenyl-4-phenylmethoxyphenyl methanone,phenyl 4-phenylmethoxy phenyl ketone,acmc-20amoo,4-benzyl-oxybenzophenone,4-benzyloxyphenyl-phenyl-methanone |
| IUPAC Name | phenyl-(4-phenylmethoxyphenyl)methanone |
| InChI Key | NMPNTBQOLRXPGK-UHFFFAOYSA-N |
| Molecular Formula | C20H16O2 |
3,9-Bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane 95.0+%, TCI America™
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CAS: 26741-53-7 Molecular Formula: C33H50O6P2 Molecular Weight (g/mol): 604.71 MDL Number: MFCD00071521 InChI Key: AIBRSVLEQRWAEG-FJGSWBKINA-N Synonym: Pentaerythritol Bis(2,4-di-tert-butylphenylphosphite) PubChem CID: 93101 IUPAC Name: 3,9-bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane SMILES: CC(C)(C)C1=CC=C(O[P@]2OC[C@]3(CO[P@](OC4=CC=C(C=C4C(C)(C)C)C(C)(C)C)OC3)CO2)C(=C1)C(C)(C)C
| PubChem CID | 93101 |
|---|---|
| CAS | 26741-53-7 |
| Molecular Weight (g/mol) | 604.71 |
| MDL Number | MFCD00071521 |
| SMILES | CC(C)(C)C1=CC=C(O[P@]2OC[C@]3(CO[P@](OC4=CC=C(C=C4C(C)(C)C)C(C)(C)C)OC3)CO2)C(=C1)C(C)(C)C |
| Synonym | Pentaerythritol Bis(2,4-di-tert-butylphenylphosphite) |
| IUPAC Name | 3,9-bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane |
| InChI Key | AIBRSVLEQRWAEG-FJGSWBKINA-N |
| Molecular Formula | C33H50O6P2 |
Bexarotene 96.0+%, TCI America™
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CAS: 153559-49-0 Molecular Formula: C24H28O2 Molecular Weight (g/mol): 348.49 MDL Number: MFCD00932428 InChI Key: NAVMQTYZDKMPEU-UHFFFAOYSA-N Synonym: bexarotene,targretin,targrexin,targretyn,targret,bexarotenum,bexarotene usan,bexaroteno,bexaroten,targretin-gel PubChem CID: 82146 ChEBI: CHEBI:50859 IUPAC Name: 4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethenyl]benzoic acid SMILES: CC1=CC2=C(C=C1C(=C)C1=CC=C(C=C1)C(O)=O)C(C)(C)CCC2(C)C
| PubChem CID | 82146 |
|---|---|
| CAS | 153559-49-0 |
| Molecular Weight (g/mol) | 348.49 |
| ChEBI | CHEBI:50859 |
| MDL Number | MFCD00932428 |
| SMILES | CC1=CC2=C(C=C1C(=C)C1=CC=C(C=C1)C(O)=O)C(C)(C)CCC2(C)C |
| Synonym | bexarotene,targretin,targrexin,targretyn,targret,bexarotenum,bexarotene usan,bexaroteno,bexaroten,targretin-gel |
| IUPAC Name | 4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethenyl]benzoic acid |
| InChI Key | NAVMQTYZDKMPEU-UHFFFAOYSA-N |
| Molecular Formula | C24H28O2 |