Benzenoids
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Dienestrol 96.0+%, TCI America™
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CAS: 84-17-3 Molecular Formula: C18H18O2 Molecular Weight (g/mol): 266.34 MDL Number: MFCD00050983 InChI Key: NFDFQCUYFHCNBW-SCGPFSFSSA-N PubChem CID: 667476 IUPAC Name: 4-[(2E,4E)-4-(4-hydroxyphenyl)hexa-2,4-dien-3-yl]phenol SMILES: CC=C(C1=CC=C(C=C1)O)C(=CC)C2=CC=C(C=C2)O
| PubChem CID | 667476 |
|---|---|
| CAS | 84-17-3 |
| Molecular Weight (g/mol) | 266.34 |
| MDL Number | MFCD00050983 |
| SMILES | CC=C(C1=CC=C(C=C1)O)C(=CC)C2=CC=C(C=C2)O |
| IUPAC Name | 4-[(2E,4E)-4-(4-hydroxyphenyl)hexa-2,4-dien-3-yl]phenol |
| InChI Key | NFDFQCUYFHCNBW-SCGPFSFSSA-N |
| Molecular Formula | C18H18O2 |
9-Nitroanthracene 90.0+%, TCI America™
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CAS: 602-60-8 Molecular Formula: C14H9NO2 Molecular Weight (g/mol): 223.231 MDL Number: MFCD00001248 InChI Key: LSIKFJXEYJIZNB-UHFFFAOYSA-N Synonym: anthracene, 9-nitro,5-nitroanthracene,unii-jz1tb3n57p,9-nitro-anthracene,ccris 4679,jz1tb3n57p,9-nitro anthracene,pubchem15119,acmc-20ab5c,9-nitroanthracene PubChem CID: 11767 ChEBI: CHEBI:82501 IUPAC Name: 9-nitroanthracene SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[N+](=O)[O-]
| PubChem CID | 11767 |
|---|---|
| CAS | 602-60-8 |
| Molecular Weight (g/mol) | 223.231 |
| ChEBI | CHEBI:82501 |
| MDL Number | MFCD00001248 |
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[N+](=O)[O-] |
| Synonym | anthracene, 9-nitro,5-nitroanthracene,unii-jz1tb3n57p,9-nitro-anthracene,ccris 4679,jz1tb3n57p,9-nitro anthracene,pubchem15119,acmc-20ab5c,9-nitroanthracene |
| IUPAC Name | 9-nitroanthracene |
| InChI Key | LSIKFJXEYJIZNB-UHFFFAOYSA-N |
| Molecular Formula | C14H9NO2 |
2-Acetamido-5-bromobenzoic Acid 98.0+%, TCI America™
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CAS: 38985-79-4 Molecular Formula: C9H7BrNO3 Molecular Weight (g/mol): 257.06 MDL Number: MFCD00040904 InChI Key: QVABAFHRLMDDLM-UHFFFAOYSA-M PubChem CID: 520935 IUPAC Name: 5-bromo-2-acetamidobenzoate SMILES: CC(=O)NC1=CC=C(Br)C=C1C([O-])=O
| PubChem CID | 520935 |
|---|---|
| CAS | 38985-79-4 |
| Molecular Weight (g/mol) | 257.06 |
| MDL Number | MFCD00040904 |
| SMILES | CC(=O)NC1=CC=C(Br)C=C1C([O-])=O |
| IUPAC Name | 5-bromo-2-acetamidobenzoate |
| InChI Key | QVABAFHRLMDDLM-UHFFFAOYSA-M |
| Molecular Formula | C9H7BrNO3 |
4-Fluorophenyl Chlorothionoformate 98.0+%, TCI America™
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CAS: 42908-73-6 Molecular Formula: C7H4ClFOS Molecular Weight (g/mol): 190.62 MDL Number: MFCD00134402 InChI Key: HZBXSUFBKXPOAF-UHFFFAOYSA-N Synonym: Chlorothioformic Acid O-(4-Fluorophenyl) Ester, O-(4-Fluorophenyl) Chlorothioformate PubChem CID: 5045332 IUPAC Name: 4-fluorophenyl chloromethanethioate SMILES: FC1=CC=C(OC(Cl)=S)C=C1
| PubChem CID | 5045332 |
|---|---|
| CAS | 42908-73-6 |
| Molecular Weight (g/mol) | 190.62 |
| MDL Number | MFCD00134402 |
| SMILES | FC1=CC=C(OC(Cl)=S)C=C1 |
| Synonym | Chlorothioformic Acid O-(4-Fluorophenyl) Ester, O-(4-Fluorophenyl) Chlorothioformate |
| IUPAC Name | 4-fluorophenyl chloromethanethioate |
| InChI Key | HZBXSUFBKXPOAF-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClFOS |
Clofibrate 98.0+%, TCI America™
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CAS: 637-07-0 Molecular Formula: C12H15ClO3 Molecular Weight (g/mol): 242.70 MDL Number: MFCD00000615 InChI Key: KNHUKKLJHYUCFP-UHFFFAOYSA-N Synonym: clofibrate,ethyl clofibrate,clofibratum,clofibrato,atromid-s,miscleron,atromid,liprin,epib,angiokapsul PubChem CID: 2796 ChEBI: CHEBI:3750 IUPAC Name: ethyl 2-(4-chlorophenoxy)-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)OC1=CC=C(Cl)C=C1
| PubChem CID | 2796 |
|---|---|
| CAS | 637-07-0 |
| Molecular Weight (g/mol) | 242.70 |
| ChEBI | CHEBI:3750 |
| MDL Number | MFCD00000615 |
| SMILES | CCOC(=O)C(C)(C)OC1=CC=C(Cl)C=C1 |
| Synonym | clofibrate,ethyl clofibrate,clofibratum,clofibrato,atromid-s,miscleron,atromid,liprin,epib,angiokapsul |
| IUPAC Name | ethyl 2-(4-chlorophenoxy)-2-methylpropanoate |
| InChI Key | KNHUKKLJHYUCFP-UHFFFAOYSA-N |
| Molecular Formula | C12H15ClO3 |
Triphenylmethylium Tetrakis(pentafluorophenyl)borate 98.0+%, TCI America™
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CAS: 136040-19-2 Molecular Formula: C43H15BF20 Molecular Weight (g/mol): 922.37 MDL Number: MFCD03426981 InChI Key: TZOSNOQHGGONMD-UHFFFAOYSA-N Synonym: triphenylmethylium tetrakis perfluorophenyl borate,trityl tetrakis pentafluorophenyl borate,trityl tetrapentafluorophenyl borate,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-,triphenylcarbenium tetrakis pentafluorophenyl borate,methylium, triphenyl-, tetrakis 2,3,4,5,6-pentafluorophenyl borate 1-1:1,tetrakis 2,3,4,5,6-pentafluorophenyl boranuide; triphenylmethylium,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-1:1,tritylium tetrakis pentafluorophenyl borate,triphenylmethyliumtetrakis pentafluorophenyl borate PubChem CID: 9832824 IUPAC Name: tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; triphenylmethylium SMILES: C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=CC=C1.FC1=C(F)C(F)=C(C(F)=C1F)[B-](C1=C(F)C(F)=C(F)C(F)=C1F)(C1=C(F)C(F)=C(F)C(F)=C1F)C1=C(F)C(F)=C(F)C(F)=C1F
| PubChem CID | 9832824 |
|---|---|
| CAS | 136040-19-2 |
| Molecular Weight (g/mol) | 922.37 |
| MDL Number | MFCD03426981 |
| SMILES | C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=CC=C1.FC1=C(F)C(F)=C(C(F)=C1F)[B-](C1=C(F)C(F)=C(F)C(F)=C1F)(C1=C(F)C(F)=C(F)C(F)=C1F)C1=C(F)C(F)=C(F)C(F)=C1F |
| Synonym | triphenylmethylium tetrakis perfluorophenyl borate,trityl tetrakis pentafluorophenyl borate,trityl tetrapentafluorophenyl borate,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-,triphenylcarbenium tetrakis pentafluorophenyl borate,methylium, triphenyl-, tetrakis 2,3,4,5,6-pentafluorophenyl borate 1-1:1,tetrakis 2,3,4,5,6-pentafluorophenyl boranuide; triphenylmethylium,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-1:1,tritylium tetrakis pentafluorophenyl borate,triphenylmethyliumtetrakis pentafluorophenyl borate |
| IUPAC Name | tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; triphenylmethylium |
| InChI Key | TZOSNOQHGGONMD-UHFFFAOYSA-N |
| Molecular Formula | C43H15BF20 |
2-Bromo-9,9-bis(2-ethylhexyl)fluorene 98.0+%, TCI America™
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CAS: 355135-07-8 Molecular Formula: C29H41Br Molecular Weight (g/mol): 469.55 MDL Number: MFCD12024275 InChI Key: JAWAIXIROBPNSH-UHFFFAOYNA-N PubChem CID: 11248391 IUPAC Name: 2-bromo-9,9-bis(2-ethylhexyl)-9H-fluorene SMILES: CCCCC(CC)CC1(CC(CC)CCCC)C2=CC=CC=C2C2=C1C=C(Br)C=C2
| PubChem CID | 11248391 |
|---|---|
| CAS | 355135-07-8 |
| Molecular Weight (g/mol) | 469.55 |
| MDL Number | MFCD12024275 |
| SMILES | CCCCC(CC)CC1(CC(CC)CCCC)C2=CC=CC=C2C2=C1C=C(Br)C=C2 |
| IUPAC Name | 2-bromo-9,9-bis(2-ethylhexyl)-9H-fluorene |
| InChI Key | JAWAIXIROBPNSH-UHFFFAOYNA-N |
| Molecular Formula | C29H41Br |
2-Amino-3-bromo-5-nitrobenzonitrile 98.0+%, TCI America™
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CAS: 17601-94-4 Molecular Formula: C7H4BrN3O2 Molecular Weight (g/mol): 242.032 MDL Number: MFCD00054185 InChI Key: MUHLVSZIVTURCZ-UHFFFAOYSA-N Synonym: benzonitrile, 2-amino-3-bromo-5-nitro,6-bromo-2-cyano-4-nitroaniline,2-bromo-6-cyano-4-nitroaniline,2-cyano-4-nitro-6-bromoaniline,2-amino-3-bromo-5-nitrobenzenecarbonitrile,pubchem2331,2-amino-3-bromo-1-cyano-5-nitrobenzene,acmc-1bus8,cambridge id 5228140,ksc496g6h PubChem CID: 87173 IUPAC Name: 2-amino-3-bromo-5-nitrobenzonitrile SMILES: C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-]
| PubChem CID | 87173 |
|---|---|
| CAS | 17601-94-4 |
| Molecular Weight (g/mol) | 242.032 |
| MDL Number | MFCD00054185 |
| SMILES | C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-] |
| Synonym | benzonitrile, 2-amino-3-bromo-5-nitro,6-bromo-2-cyano-4-nitroaniline,2-bromo-6-cyano-4-nitroaniline,2-cyano-4-nitro-6-bromoaniline,2-amino-3-bromo-5-nitrobenzenecarbonitrile,pubchem2331,2-amino-3-bromo-1-cyano-5-nitrobenzene,acmc-1bus8,cambridge id 5228140,ksc496g6h |
| IUPAC Name | 2-amino-3-bromo-5-nitrobenzonitrile |
| InChI Key | MUHLVSZIVTURCZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrN3O2 |
1-Naphthylhydrazine Hydrochloride 90.0+%, TCI America™
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CAS: 2243-56-3 Molecular Formula: C10H11ClN2 Molecular Weight (g/mol): 194.662 MDL Number: MFCD00060157 InChI Key: FYSSYOCJFZSKNW-UHFFFAOYSA-N PubChem CID: 519949 IUPAC Name: naphthalen-1-ylhydrazine;hydrochloride SMILES: C1=CC=C2C(=C1)C=CC=C2NN.Cl
| PubChem CID | 519949 |
|---|---|
| CAS | 2243-56-3 |
| Molecular Weight (g/mol) | 194.662 |
| MDL Number | MFCD00060157 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2NN.Cl |
| IUPAC Name | naphthalen-1-ylhydrazine;hydrochloride |
| InChI Key | FYSSYOCJFZSKNW-UHFFFAOYSA-N |
| Molecular Formula | C10H11ClN2 |
N-Allylbenzylamine 97.0+%, TCI America™
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CAS: 4383-22-6 Molecular Formula: C10H13N Molecular Weight (g/mol): 147.22 MDL Number: MFCD00463446 InChI Key: RHUCQDQRNUUMKY-UHFFFAOYSA-N Synonym: 3-(Benzylamino)-1-propene, N-Benzylallylamine PubChem CID: 521150 IUPAC Name: benzyl(prop-2-en-1-yl)amine SMILES: C=CCNCC1=CC=CC=C1
| PubChem CID | 521150 |
|---|---|
| CAS | 4383-22-6 |
| Molecular Weight (g/mol) | 147.22 |
| MDL Number | MFCD00463446 |
| SMILES | C=CCNCC1=CC=CC=C1 |
| Synonym | 3-(Benzylamino)-1-propene, N-Benzylallylamine |
| IUPAC Name | benzyl(prop-2-en-1-yl)amine |
| InChI Key | RHUCQDQRNUUMKY-UHFFFAOYSA-N |
| Molecular Formula | C10H13N |
3-Chloro-2-methylaniline Hydrochloride 98.0+%, TCI America™
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CAS: 6259-40-1 Molecular Formula: C7H9Cl2N Molecular Weight (g/mol): 178.056 MDL Number: MFCD00058279 InChI Key: WCZGXAZCBNLQJB-UHFFFAOYSA-N Synonym: 2-Amino-6-chlorotoluene Hydrochloride, 3-Chloro-o-toluidine Hydrochloride PubChem CID: 80415 IUPAC Name: 3-chloro-2-methylaniline;hydrochloride SMILES: CC1=C(C=CC=C1Cl)N.Cl
| PubChem CID | 80415 |
|---|---|
| CAS | 6259-40-1 |
| Molecular Weight (g/mol) | 178.056 |
| MDL Number | MFCD00058279 |
| SMILES | CC1=C(C=CC=C1Cl)N.Cl |
| Synonym | 2-Amino-6-chlorotoluene Hydrochloride, 3-Chloro-o-toluidine Hydrochloride |
| IUPAC Name | 3-chloro-2-methylaniline;hydrochloride |
| InChI Key | WCZGXAZCBNLQJB-UHFFFAOYSA-N |
| Molecular Formula | C7H9Cl2N |
4-Phenoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2734377 |
|---|---|
| CAS | 51067-38-0 |
| MDL Number | MFCD00093312 |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-phenoxyphenyl)boronic acid |
| InChI Key | KFXUHRXGLWUOJT-UHFFFAOYSA-N |
| Molecular Formula | C12H11BO3 |
| Formula Weight | 214.03 |
| Melting Point | 115°C |
3-Bromophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 89598-96-9 Molecular Formula: C6H6BBrO2 Molecular Weight (g/mol): 200.83 MDL Number: MFCD00239386 InChI Key: AFSSVCNPDKKSRR-UHFFFAOYSA-N Synonym: 3-bromophenyl boronic acid,3-bromobenzeneboronic acid,3-bromophenylboronicacid,boronic acid, 3-bromophenyl,pubchem1758,3-bromo-phenylboronic acid,acmc-209r1w,3-bromo-benzeneboronic acid,3-bromobenzene boronic acid PubChem CID: 2734318 IUPAC Name: (3-bromophenyl)boronic acid SMILES: OB(O)C1=CC=CC(Br)=C1
| PubChem CID | 2734318 |
|---|---|
| CAS | 89598-96-9 |
| Molecular Weight (g/mol) | 200.83 |
| MDL Number | MFCD00239386 |
| SMILES | OB(O)C1=CC=CC(Br)=C1 |
| Synonym | 3-bromophenyl boronic acid,3-bromobenzeneboronic acid,3-bromophenylboronicacid,boronic acid, 3-bromophenyl,pubchem1758,3-bromo-phenylboronic acid,acmc-209r1w,3-bromo-benzeneboronic acid,3-bromobenzene boronic acid |
| IUPAC Name | (3-bromophenyl)boronic acid |
| InChI Key | AFSSVCNPDKKSRR-UHFFFAOYSA-N |
| Molecular Formula | C6H6BBrO2 |
Anisonitrile 98.0+%, TCI America™
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CAS: 874-90-8 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001818 InChI Key: XDJAAZYHCCRJOK-UHFFFAOYSA-N Synonym: anisonitrile,p-anisonitrile,4-cyanoanisole,benzonitrile, 4-methoxy,p-methoxybenzonitrile,4-anisonitrile,p-anisylnitrile,p-cyanoanisole,p-methoxyphenyl cyanide,4-methoxy benzonitrile PubChem CID: 70129 IUPAC Name: 4-methoxybenzonitrile SMILES: COC1=CC=C(C=C1)C#N
| PubChem CID | 70129 |
|---|---|
| CAS | 874-90-8 |
| Molecular Weight (g/mol) | 133.15 |
| MDL Number | MFCD00001818 |
| SMILES | COC1=CC=C(C=C1)C#N |
| Synonym | anisonitrile,p-anisonitrile,4-cyanoanisole,benzonitrile, 4-methoxy,p-methoxybenzonitrile,4-anisonitrile,p-anisylnitrile,p-cyanoanisole,p-methoxyphenyl cyanide,4-methoxy benzonitrile |
| IUPAC Name | 4-methoxybenzonitrile |
| InChI Key | XDJAAZYHCCRJOK-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
4,4'-Diaminooctafluorobiphenyl 97.0+%, TCI America™
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CAS: 1038-66-0 Molecular Formula: C12H4F8N2 Molecular Weight (g/mol): 328.165 MDL Number: MFCD00007646 InChI Key: FWOLORXQTIGHFX-UHFFFAOYSA-N Synonym: 4,4'-diaminooctafluorobiphenyl,octafluorobenzidine,4,4'-diaminooctafluorodiphenyl,2,2',3,3',5,5',6,6'-octafluorobenzidine,1,1'-biphenyl-4,4'-diamine, 2,2',3,3',5,5',6,6'-octafluoro,4,4'-diaminoctafluorobiphenyl,benzidine, octafluoro,4,4'-biphenyldiamine, 2,2',3,3',5,5',6,6'-octafluoro,benzidine, 2,2',3,3',5,5',6,6'-octafluoro,2,2',3,3',5,5',6,6'-octafluoro-4,4'-bibenzenamine PubChem CID: 70582 IUPAC Name: 4-(4-amino-2,3,5,6-tetrafluorophenyl)-2,3,5,6-tetrafluoroaniline SMILES: C1(=C(C(=C(C(=C1F)F)N)F)F)C2=C(C(=C(C(=C2F)F)N)F)F
| PubChem CID | 70582 |
|---|---|
| CAS | 1038-66-0 |
| Molecular Weight (g/mol) | 328.165 |
| MDL Number | MFCD00007646 |
| SMILES | C1(=C(C(=C(C(=C1F)F)N)F)F)C2=C(C(=C(C(=C2F)F)N)F)F |
| Synonym | 4,4'-diaminooctafluorobiphenyl,octafluorobenzidine,4,4'-diaminooctafluorodiphenyl,2,2',3,3',5,5',6,6'-octafluorobenzidine,1,1'-biphenyl-4,4'-diamine, 2,2',3,3',5,5',6,6'-octafluoro,4,4'-diaminoctafluorobiphenyl,benzidine, octafluoro,4,4'-biphenyldiamine, 2,2',3,3',5,5',6,6'-octafluoro,benzidine, 2,2',3,3',5,5',6,6'-octafluoro,2,2',3,3',5,5',6,6'-octafluoro-4,4'-bibenzenamine |
| IUPAC Name | 4-(4-amino-2,3,5,6-tetrafluorophenyl)-2,3,5,6-tetrafluoroaniline |
| InChI Key | FWOLORXQTIGHFX-UHFFFAOYSA-N |
| Molecular Formula | C12H4F8N2 |