Benzenoids
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Anthracene-2,6-diyl Bis(trifluoromethanesulfonate) 98.0+%, TCI America™
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CAS: 594838-61-6 Molecular Formula: C16H8F6O6S2 Molecular Weight (g/mol): 474.344 InChI Key: ZGOORSQUXBKABZ-UHFFFAOYSA-N Synonym: 2,6-Bis(trifluoromethanesulfonyloxy)anthracene PubChem CID: 57587335 IUPAC Name: [6-(trifluoromethylsulfonyloxy)anthracen-2-yl] trifluoromethanesulfonate SMILES: C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
| PubChem CID | 57587335 |
|---|---|
| CAS | 594838-61-6 |
| Molecular Weight (g/mol) | 474.344 |
| SMILES | C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F |
| Synonym | 2,6-Bis(trifluoromethanesulfonyloxy)anthracene |
| IUPAC Name | [6-(trifluoromethylsulfonyloxy)anthracen-2-yl] trifluoromethanesulfonate |
| InChI Key | ZGOORSQUXBKABZ-UHFFFAOYSA-N |
| Molecular Formula | C16H8F6O6S2 |
9,9'-Spirobi[9H-fluorene]-2-boronic Acid, TCI America™
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| PubChem CID | 22564369 |
|---|---|
| CAS | 236389-21-2 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| InChI Key | WDDLHUWVLROJLA-UHFFFAOYSA-N |
| Molecular Formula | C25H17BO2 |
| Formula Weight | 360.22 |
4-Bromo-2,2-diphenylbutyronitrile 95.0+%, TCI America™
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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 |
Benzenesulfonyl Hydrazide 98.0+%, TCI America™
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CAS: 80-17-1 Molecular Formula: C6H8N2O2S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00007583,MFCD08064450 InChI Key: VJRITMATACIYAF-UHFFFAOYSA-N Synonym: benzenesulfonyl hydrazide,porofor,benzenesulfonic acid, hydrazide,porofor bsh,benzenesulfohydrazide,phenylsulfonylhydrazine,genitron bsh,celogen bsh,benzenesulfonylhydrazine,phenylsulfohydrazide PubChem CID: 65723 IUPAC Name: benzenesulfonohydrazide SMILES: NNS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 65723 |
|---|---|
| CAS | 80-17-1 |
| Molecular Weight (g/mol) | 172.20 |
| MDL Number | MFCD00007583,MFCD08064450 |
| SMILES | NNS(=O)(=O)C1=CC=CC=C1 |
| Synonym | benzenesulfonyl hydrazide,porofor,benzenesulfonic acid, hydrazide,porofor bsh,benzenesulfohydrazide,phenylsulfonylhydrazine,genitron bsh,celogen bsh,benzenesulfonylhydrazine,phenylsulfohydrazide |
| IUPAC Name | benzenesulfonohydrazide |
| InChI Key | VJRITMATACIYAF-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2S |
4,4'-Diiodo-2,2'-dimethylbiphenyl 98.0+%, TCI America™
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CAS: 69571-02-4 Molecular Formula: C14H12I2 Molecular Weight (g/mol): 434.06 MDL Number: MFCD13185944 InChI Key: WHFMNDMHTIOIMS-UHFFFAOYSA-N PubChem CID: 13797298 IUPAC Name: 4,4'-diiodo-2,2'-dimethyl-1,1'-biphenyl SMILES: CC1=C(C=CC(I)=C1)C1=C(C)C=C(I)C=C1
| PubChem CID | 13797298 |
|---|---|
| CAS | 69571-02-4 |
| Molecular Weight (g/mol) | 434.06 |
| MDL Number | MFCD13185944 |
| SMILES | CC1=C(C=CC(I)=C1)C1=C(C)C=C(I)C=C1 |
| IUPAC Name | 4,4'-diiodo-2,2'-dimethyl-1,1'-biphenyl |
| InChI Key | WHFMNDMHTIOIMS-UHFFFAOYSA-N |
| Molecular Formula | C14H12I2 |
5-Amino-2-methylbenzonitrile 98.0+%, TCI America™
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CAS: 50670-64-9 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.166 MDL Number: MFCD00017608 InChI Key: YDZVQWCVKXYGIU-UHFFFAOYSA-N Synonym: 5-amino-2-methylbenzenecarbonitrile,2-methyl-5-aminobenzonitrile,4-amino-2-cyanotoluene,3-cyano-4-methylaniline,5-amino-2-methyl-benzonitrile,benzonitrile, 5-amino-2-methyl,5-amino-o-tolunitrile,acmc-20a01k,aminomethylbenzenecarbonitrile,3-amino-6-methylbenzonitrile PubChem CID: 2735365 IUPAC Name: 5-amino-2-methylbenzonitrile SMILES: CC1=C(C=C(C=C1)N)C#N
| PubChem CID | 2735365 |
|---|---|
| CAS | 50670-64-9 |
| Molecular Weight (g/mol) | 132.166 |
| MDL Number | MFCD00017608 |
| SMILES | CC1=C(C=C(C=C1)N)C#N |
| Synonym | 5-amino-2-methylbenzenecarbonitrile,2-methyl-5-aminobenzonitrile,4-amino-2-cyanotoluene,3-cyano-4-methylaniline,5-amino-2-methyl-benzonitrile,benzonitrile, 5-amino-2-methyl,5-amino-o-tolunitrile,acmc-20a01k,aminomethylbenzenecarbonitrile,3-amino-6-methylbenzonitrile |
| IUPAC Name | 5-amino-2-methylbenzonitrile |
| InChI Key | YDZVQWCVKXYGIU-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
Bianthrone 95.0+%, TCI America™
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CAS: 434-85-5 Molecular Formula: C28H16O2 Molecular Weight (g/mol): 384.434 MDL Number: MFCD00001238 InChI Key: MGRRGKWPEVFJSH-UHFFFAOYSA-N Synonym: bianthrone,10h,10'h-9,9'-bianthracenylidene-10,10'-dione,dehydrodianthrone,9 10h-anthracenone, 10-10-oxo-9 10h-anthracenylidene,.delta.10,10'-bianthrone,10-10-oxo-9-anthrylidene anthracen-9-one,10-10-oxoanthracen-9-ylidene anthracen-9-one,bisanthrone,10-10-oxoanthracen-9 10h-ylidene anthracen-9 10h-one,9,9'-bianthracenylidene-10,10'-dione PubChem CID: 67948 IUPAC Name: 10-(10-oxoanthracen-9-ylidene)anthracen-9-one SMILES: C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O
| PubChem CID | 67948 |
|---|---|
| CAS | 434-85-5 |
| Molecular Weight (g/mol) | 384.434 |
| MDL Number | MFCD00001238 |
| SMILES | C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O |
| Synonym | bianthrone,10h,10'h-9,9'-bianthracenylidene-10,10'-dione,dehydrodianthrone,9 10h-anthracenone, 10-10-oxo-9 10h-anthracenylidene,.delta.10,10'-bianthrone,10-10-oxo-9-anthrylidene anthracen-9-one,10-10-oxoanthracen-9-ylidene anthracen-9-one,bisanthrone,10-10-oxoanthracen-9 10h-ylidene anthracen-9 10h-one,9,9'-bianthracenylidene-10,10'-dione |
| IUPAC Name | 10-(10-oxoanthracen-9-ylidene)anthracen-9-one |
| InChI Key | MGRRGKWPEVFJSH-UHFFFAOYSA-N |
| Molecular Formula | C28H16O2 |
Violanthrone 79 95.0+%, TCI America™
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CAS: 85652-50-2 Molecular Formula: C50H48O4 Molecular Weight (g/mol): 712.93 MDL Number: MFCD00491570 InChI Key: LLPQZABTDLOYAL-UHFFFAOYSA-N Synonym: violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione PubChem CID: 16217791 SMILES: CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC
| PubChem CID | 16217791 |
|---|---|
| CAS | 85652-50-2 |
| Molecular Weight (g/mol) | 712.93 |
| MDL Number | MFCD00491570 |
| SMILES | CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC |
| Synonym | violanthrone-79,violanthrone 79,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy,anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,1,16,17-bis n-octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy-anthra 9,1,2-cde benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde-benzo rst pentaphene-5,10-dione,16,17-bis octyloxy anthra 9,1,2-cde benzo rst pentaphene-5,10-dione |
| InChI Key | LLPQZABTDLOYAL-UHFFFAOYSA-N |
| Molecular Formula | C50H48O4 |
2-Chlorobenzyl Chloride 99.0+%, TCI America™
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CAS: 611-19-8 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.025 MDL Number: MFCD00000893 InChI Key: BASMANVIUSSIIM-UHFFFAOYSA-N Synonym: 2-chlorobenzyl chloride,1-chloro-2-chloromethyl benzene,2-chlorobenzylchloride,o-chlorobenzyl chloride,alpha,2-dichlorotoluene,benzene, 1-chloro-2-chloromethyl,alpha,o-dichlorotoluene,ar,alpha-dichlorotoluene,ortho-alpha-dichlorotoluene,unii-h58di83rmd PubChem CID: 11906 IUPAC Name: 1-chloro-2-(chloromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)Cl
| PubChem CID | 11906 |
|---|---|
| CAS | 611-19-8 |
| Molecular Weight (g/mol) | 161.025 |
| MDL Number | MFCD00000893 |
| SMILES | C1=CC=C(C(=C1)CCl)Cl |
| Synonym | 2-chlorobenzyl chloride,1-chloro-2-chloromethyl benzene,2-chlorobenzylchloride,o-chlorobenzyl chloride,alpha,2-dichlorotoluene,benzene, 1-chloro-2-chloromethyl,alpha,o-dichlorotoluene,ar,alpha-dichlorotoluene,ortho-alpha-dichlorotoluene,unii-h58di83rmd |
| IUPAC Name | 1-chloro-2-(chloromethyl)benzene |
| InChI Key | BASMANVIUSSIIM-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2 |
3-Chloro-5-hydroxybenzoic Acid 98.0+%, TCI America™
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CAS: 53984-36-4 Molecular Formula: C7H5ClO3 Molecular Weight (g/mol): 172.56 MDL Number: MFCD04114327 InChI Key: RJOLIYHZZKAIET-UHFFFAOYSA-N PubChem CID: 13071646 IUPAC Name: 3-chloro-5-hydroxybenzoic acid SMILES: OC(=O)C1=CC(O)=CC(Cl)=C1
| PubChem CID | 13071646 |
|---|---|
| CAS | 53984-36-4 |
| Molecular Weight (g/mol) | 172.56 |
| MDL Number | MFCD04114327 |
| SMILES | OC(=O)C1=CC(O)=CC(Cl)=C1 |
| IUPAC Name | 3-chloro-5-hydroxybenzoic acid |
| InChI Key | RJOLIYHZZKAIET-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO3 |
2,6-Dibromoanisole 98.0+%, TCI America™
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CAS: 38603-09-7 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.93 MDL Number: MFCD00093270 InChI Key: BMZVDHQOAJUZJL-UHFFFAOYSA-N Synonym: 1,3-Dibromo-2-methoxybenzene PubChem CID: 181584 IUPAC Name: 1,3-dibromo-2-methoxybenzene SMILES: COC1=C(Br)C=CC=C1Br
| PubChem CID | 181584 |
|---|---|
| CAS | 38603-09-7 |
| Molecular Weight (g/mol) | 265.93 |
| MDL Number | MFCD00093270 |
| SMILES | COC1=C(Br)C=CC=C1Br |
| Synonym | 1,3-Dibromo-2-methoxybenzene |
| IUPAC Name | 1,3-dibromo-2-methoxybenzene |
| InChI Key | BMZVDHQOAJUZJL-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
2,7-Diamino-9,9-di-n-octylfluorene 98.0+%, TCI America™
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CAS: 851042-10-9 Molecular Formula: C29H44N2 Molecular Weight (g/mol): 420.69 MDL Number: MFCD27923070 InChI Key: ODJBGRHFVFWTBO-UHFFFAOYSA-N PubChem CID: 59306005 IUPAC Name: 9,9-dioctyl-9H-fluorene-2,7-diamine SMILES: CCCCCCCCC1(CCCCCCCC)C2=C(C=CC(N)=C2)C2=C1C=C(N)C=C2
| PubChem CID | 59306005 |
|---|---|
| CAS | 851042-10-9 |
| Molecular Weight (g/mol) | 420.69 |
| MDL Number | MFCD27923070 |
| SMILES | CCCCCCCCC1(CCCCCCCC)C2=C(C=CC(N)=C2)C2=C1C=C(N)C=C2 |
| IUPAC Name | 9,9-dioctyl-9H-fluorene-2,7-diamine |
| InChI Key | ODJBGRHFVFWTBO-UHFFFAOYSA-N |
| Molecular Formula | C29H44N2 |
1-Bromo-2-chloro-3-fluorobenzene 98.0+%, TCI America™
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CAS: 883499-24-9 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.442 MDL Number: MFCD04038306 InChI Key: GTIWFNAUYPVPAT-UHFFFAOYSA-N PubChem CID: 3739301 IUPAC Name: 1-bromo-2-chloro-3-fluorobenzene SMILES: C1=CC(=C(C(=C1)Br)Cl)F
| PubChem CID | 3739301 |
|---|---|
| CAS | 883499-24-9 |
| Molecular Weight (g/mol) | 209.442 |
| MDL Number | MFCD04038306 |
| SMILES | C1=CC(=C(C(=C1)Br)Cl)F |
| IUPAC Name | 1-bromo-2-chloro-3-fluorobenzene |
| InChI Key | GTIWFNAUYPVPAT-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClF |
Nortriptyline Hydrochloride 98.0+%, TCI America™
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CAS: 894-71-3 Molecular Formula: C19H22ClN Molecular Weight (g/mol): 299.84 MDL Number: MFCD00058024 InChI Key: SHAYBENGXDALFF-UHFFFAOYSA-N Synonym: nortriptyline hydrochloride,pamelor,allegron,altilev,nortrilen,desmethylamitriptyline hydrochloride,acetexa,psychostyl,sensival,vividyl PubChem CID: 441358 IUPAC Name: hydrogen methyl(3-{tricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine chloride SMILES: [H+].[Cl-].CNCCC=C1C2=CC=CC=C2CCC2=CC=CC=C12
| PubChem CID | 441358 |
|---|---|
| CAS | 894-71-3 |
| Molecular Weight (g/mol) | 299.84 |
| MDL Number | MFCD00058024 |
| SMILES | [H+].[Cl-].CNCCC=C1C2=CC=CC=C2CCC2=CC=CC=C12 |
| Synonym | nortriptyline hydrochloride,pamelor,allegron,altilev,nortrilen,desmethylamitriptyline hydrochloride,acetexa,psychostyl,sensival,vividyl |
| IUPAC Name | hydrogen methyl(3-{tricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine chloride |
| InChI Key | SHAYBENGXDALFF-UHFFFAOYSA-N |
| Molecular Formula | C19H22ClN |
2-Phenoxyethanol 98.5+%, TCI America™
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CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO
| PubChem CID | 31236 |
|---|---|
| CAS | 122-99-6 |
| Molecular Weight (g/mol) | 138.166 |
| ChEBI | CHEBI:64275 |
| MDL Number | MFCD00002857 |
| SMILES | C1=CC=C(C=C1)OCCO |
| Synonym | phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane |
| IUPAC Name | 2-phenoxyethanol |
| InChI Key | QCDWFXQBSFUVSP-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |