Benzene and substituted derivatives
Filtered Search Results
Sodium 2,4-Dinitrobenzenesulfonate Hydrate 98.0+%, TCI America™
CAS: 885-62-1 Molecular Formula: C6H3N2NaO7S Molecular Weight (g/mol): 270.15 MDL Number: MFCD00007471,MFCD10567393 InChI Key: GSBYVRKLPCSLNV-UHFFFAOYSA-M Synonym: sodium 2,4-dinitrobenzenesulfonate hydrate,acmc-209quh,sodium dnbs hydrate,2,4-dinitrobenzenesulfonic acid sodium salt hydrate PubChem CID: 70700115 IUPAC Name: sodium 2,4-dinitrobenzene-1-sulfonate SMILES: [Na+].[O-][N+](=O)C1=CC=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O
| PubChem CID | 70700115 |
|---|---|
| CAS | 885-62-1 |
| Molecular Weight (g/mol) | 270.15 |
| MDL Number | MFCD00007471,MFCD10567393 |
| SMILES | [Na+].[O-][N+](=O)C1=CC=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O |
| Synonym | sodium 2,4-dinitrobenzenesulfonate hydrate,acmc-209quh,sodium dnbs hydrate,2,4-dinitrobenzenesulfonic acid sodium salt hydrate |
| IUPAC Name | sodium 2,4-dinitrobenzene-1-sulfonate |
| InChI Key | GSBYVRKLPCSLNV-UHFFFAOYSA-M |
| Molecular Formula | C6H3N2NaO7S |
4-Fluoro-3-(trifluoromethyl)benzaldehyde 97.0+%, TCI America™
CAS: 67515-60-0 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 InChI Key: BIUDHHGROGJSHN-UHFFFAOYSA-N Synonym: 4-fluoro-3-trifluoromethyl benzaldehyde,3-trifluoromethyl-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-m-tolualdehyde,pubchem1462,acmc-209nzm,ksc359a9l,4-fluoro-3-trifluoromethyl PubChem CID: 522269 IUPAC Name: 4-fluoro-3-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=C(C=C1C=O)C(F)(F)F)F
| PubChem CID | 522269 |
|---|---|
| CAS | 67515-60-0 |
| Molecular Weight (g/mol) | 192.113 |
| SMILES | C1=CC(=C(C=C1C=O)C(F)(F)F)F |
| Synonym | 4-fluoro-3-trifluoromethyl benzaldehyde,3-trifluoromethyl-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-m-tolualdehyde,pubchem1462,acmc-209nzm,ksc359a9l,4-fluoro-3-trifluoromethyl |
| IUPAC Name | 4-fluoro-3-(trifluoromethyl)benzaldehyde |
| InChI Key | BIUDHHGROGJSHN-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4O |
4-(4-Bromophenyl)dibenzothiophene 98.0+%, TCI America™
CAS: 530402-77-8 Molecular Formula: C18H11BrS Molecular Weight (g/mol): 339.25 MDL Number: MFCD19441307 InChI Key: FIAXBPCUAUSGJH-UHFFFAOYSA-N PubChem CID: 59866463 IUPAC Name: 4-(4-bromophenyl)dibenzothiophene SMILES: C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)C4=CC=C(C=C4)Br
| PubChem CID | 59866463 |
|---|---|
| CAS | 530402-77-8 |
| Molecular Weight (g/mol) | 339.25 |
| MDL Number | MFCD19441307 |
| SMILES | C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)C4=CC=C(C=C4)Br |
| IUPAC Name | 4-(4-bromophenyl)dibenzothiophene |
| InChI Key | FIAXBPCUAUSGJH-UHFFFAOYSA-N |
| Molecular Formula | C18H11BrS |
2,3-Difluorobenzyl Alcohol 98.0+%, TCI America™
CAS: 75853-18-8 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.121 MDL Number: MFCD00010312 InChI Key: JSFGDUIJQWWBGY-UHFFFAOYSA-N Synonym: 2,3-difluorobenzyl alcohol,2,3-difluorophenyl methanol,2,3-difluorobenzylalcohol,2,3-difluorophenylalcohol,benzenemethanol, 2,3-difluoro,2,3-difluorophenyl methan-1-ol,pubchem7358,2,3-diflorobenzyl alcohol,2,3difluorophenyl methanol,2,3 difluorophenyl methanol PubChem CID: 447153 ChEBI: CHEBI:41883 IUPAC Name: (2,3-difluorophenyl)methanol SMILES: C1=CC(=C(C(=C1)F)F)CO
| PubChem CID | 447153 |
|---|---|
| CAS | 75853-18-8 |
| Molecular Weight (g/mol) | 144.121 |
| ChEBI | CHEBI:41883 |
| MDL Number | MFCD00010312 |
| SMILES | C1=CC(=C(C(=C1)F)F)CO |
| Synonym | 2,3-difluorobenzyl alcohol,2,3-difluorophenyl methanol,2,3-difluorobenzylalcohol,2,3-difluorophenylalcohol,benzenemethanol, 2,3-difluoro,2,3-difluorophenyl methan-1-ol,pubchem7358,2,3-diflorobenzyl alcohol,2,3difluorophenyl methanol,2,3 difluorophenyl methanol |
| IUPAC Name | (2,3-difluorophenyl)methanol |
| InChI Key | JSFGDUIJQWWBGY-UHFFFAOYSA-N |
| Molecular Formula | C7H6F2O |
2,2-Diphenylpropionic Acid 96.0+%, TCI America™
CAS: 5558-66-7 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.275 MDL Number: MFCD00004189 InChI Key: ODELFXJUOVNEFZ-UHFFFAOYSA-N Synonym: 2,2-diphenylpropionic acid,2,2-diphenylpropionicacid,a,a-diphenylpropionic acid,alpha,alpha-diphenylpropionic acid,acmc-209lnv,cambridge id 7170182,2,2-diphenyl propanoic acid,2,2-diphenyl propionic acid,2,2-di phenyl propanoic acid,# PubChem CID: 79676 IUPAC Name: 2,2-diphenylpropanoic acid SMILES: CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)O
| PubChem CID | 79676 |
|---|---|
| CAS | 5558-66-7 |
| Molecular Weight (g/mol) | 226.275 |
| MDL Number | MFCD00004189 |
| SMILES | CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)O |
| Synonym | 2,2-diphenylpropionic acid,2,2-diphenylpropionicacid,a,a-diphenylpropionic acid,alpha,alpha-diphenylpropionic acid,acmc-209lnv,cambridge id 7170182,2,2-diphenyl propanoic acid,2,2-diphenyl propionic acid,2,2-di phenyl propanoic acid,# |
| IUPAC Name | 2,2-diphenylpropanoic acid |
| InChI Key | ODELFXJUOVNEFZ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
2-Chloro-5-fluorotoluene 97.0+%, TCI America™
CAS: 33406-96-1 Molecular Formula: C7H6ClF Molecular Weight (g/mol): 144.573 MDL Number: MFCD00040853 InChI Key: NIOGDCDTKPQEAT-UHFFFAOYSA-N Synonym: 2-chloro-5-fluorotoluene,3-fluoro-6-chlorotoluene,benzene, 1-chloro-4-fluoro-2-methyl,1-chlor-4-fluor-2-methylbenzol,pubchem1606,acmc-1ajiz,ksc493m2j,6-chloro-3-fluorotoluene PubChem CID: 118475 IUPAC Name: 1-chloro-4-fluoro-2-methylbenzene SMILES: CC1=C(C=CC(=C1)F)Cl
| PubChem CID | 118475 |
|---|---|
| CAS | 33406-96-1 |
| Molecular Weight (g/mol) | 144.573 |
| MDL Number | MFCD00040853 |
| SMILES | CC1=C(C=CC(=C1)F)Cl |
| Synonym | 2-chloro-5-fluorotoluene,3-fluoro-6-chlorotoluene,benzene, 1-chloro-4-fluoro-2-methyl,1-chlor-4-fluor-2-methylbenzol,pubchem1606,acmc-1ajiz,ksc493m2j,6-chloro-3-fluorotoluene |
| IUPAC Name | 1-chloro-4-fluoro-2-methylbenzene |
| InChI Key | NIOGDCDTKPQEAT-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClF |
3-Nitrophenoxyacetic Acid 98.0+%, TCI America™
CAS: 1878-88-2 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00059826 InChI Key: BNRRQAASFDGMMQ-UHFFFAOYSA-N Synonym: 3-nitrophenoxyacetic acid,3-nitrophenoxy acetic acid,2-3-nitrophenoxy acetic acid,m-nitrophenoxyacetic acid,3-nitrophenoxy-acetic acid,acmc-209eqk,3-nitrophenoxyaceticacid,3-nitro-phenoxy-acetic acid PubChem CID: 74656 SMILES: C1=CC(=CC(=C1)OCC(=O)O)[N+](=O)[O-]
| PubChem CID | 74656 |
|---|---|
| CAS | 1878-88-2 |
| Molecular Weight (g/mol) | 197.146 |
| MDL Number | MFCD00059826 |
| SMILES | C1=CC(=CC(=C1)OCC(=O)O)[N+](=O)[O-] |
| Synonym | 3-nitrophenoxyacetic acid,3-nitrophenoxy acetic acid,2-3-nitrophenoxy acetic acid,m-nitrophenoxyacetic acid,3-nitrophenoxy-acetic acid,acmc-209eqk,3-nitrophenoxyaceticacid,3-nitro-phenoxy-acetic acid |
| InChI Key | BNRRQAASFDGMMQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
2,3,4,6-Tetra-O-benzyl-D-glucopyranosyl Fluoride 96.0+%, TCI America™
CAS: 122741-44-0 Molecular Formula: C34H35FO5 Molecular Weight (g/mol): 542.65 MDL Number: MFCD01862264 InChI Key: QNXIKNZDQVSBCO-UHFFFAOYNA-N PubChem CID: 133556312 IUPAC Name: 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane SMILES: FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1
| PubChem CID | 133556312 |
|---|---|
| CAS | 122741-44-0 |
| Molecular Weight (g/mol) | 542.65 |
| MDL Number | MFCD01862264 |
| SMILES | FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1 |
| IUPAC Name | 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane |
| InChI Key | QNXIKNZDQVSBCO-UHFFFAOYNA-N |
| Molecular Formula | C34H35FO5 |
4-Methoxy-4'-nitrostilbene 98.0+%, TCI America™
CAS: 1472-68-0 Molecular Formula: C15H13NO3 Molecular Weight (g/mol): 255.273 MDL Number: MFCD00143335 InChI Key: PDFBJCRLHMEJQP-NSCUHMNNSA-N PubChem CID: 745105 ChEBI: CHEBI:34006 IUPAC Name: 1-[(E)-2-(4-methoxyphenyl)ethenyl]-4-nitrobenzene SMILES: COC1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]
| PubChem CID | 745105 |
|---|---|
| CAS | 1472-68-0 |
| Molecular Weight (g/mol) | 255.273 |
| ChEBI | CHEBI:34006 |
| MDL Number | MFCD00143335 |
| SMILES | COC1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-] |
| IUPAC Name | 1-[(E)-2-(4-methoxyphenyl)ethenyl]-4-nitrobenzene |
| InChI Key | PDFBJCRLHMEJQP-NSCUHMNNSA-N |
| Molecular Formula | C15H13NO3 |
1,3-Bis(4-methoxyphenoxy)benzene 98.0+%, TCI America™
CAS: 13118-91-7 Molecular Formula: C20H18O4 Molecular Weight (g/mol): 322.36 MDL Number: MFCD00142506 InChI Key: MUFYVNCRQIHDCE-UHFFFAOYSA-N PubChem CID: 629519 IUPAC Name: 1,3-bis(4-methoxyphenoxy)benzene SMILES: COC1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=C(C=C3)OC
| PubChem CID | 629519 |
|---|---|
| CAS | 13118-91-7 |
| Molecular Weight (g/mol) | 322.36 |
| MDL Number | MFCD00142506 |
| SMILES | COC1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=C(C=C3)OC |
| IUPAC Name | 1,3-bis(4-methoxyphenoxy)benzene |
| InChI Key | MUFYVNCRQIHDCE-UHFFFAOYSA-N |
| Molecular Formula | C20H18O4 |
1-Bromo-4-n-octylbenzene 98.0+%, TCI America™
CAS: 51554-93-9 Molecular Formula: C14H21Br Molecular Weight (g/mol): 269.226 MDL Number: MFCD00038348 InChI Key: OOZQSVXPBCINJF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene PubChem CID: 142854 IUPAC Name: 1-bromo-4-octylbenzene SMILES: CCCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 142854 |
|---|---|
| CAS | 51554-93-9 |
| Molecular Weight (g/mol) | 269.226 |
| MDL Number | MFCD00038348 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene |
| IUPAC Name | 1-bromo-4-octylbenzene |
| InChI Key | OOZQSVXPBCINJF-UHFFFAOYSA-N |
| Molecular Formula | C14H21Br |
2-(3-Fluorophenyl)ethanol 98.0+%, TCI America™
CAS: 52059-53-7 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.16 MDL Number: MFCD00045998 InChI Key: MZNBGEKFZCWVES-UHFFFAOYSA-N Synonym: 2-3-fluorophenyl ethanol,3-fluorophenethyl alcohol,2-3-fluorophenyl ethan-1-ol,benzeneethanol, 3-fluoro,3-fluorophenethylalcohol,2-3-fluorophenyl ethylalcohol,3-fluorobenzenethanol,3-fluorophenylethanol,3-fluorobenzeneethanol,acmc-209kxl PubChem CID: 573132 IUPAC Name: 2-(3-fluorophenyl)ethan-1-ol SMILES: OCCC1=CC=CC(F)=C1
| PubChem CID | 573132 |
|---|---|
| CAS | 52059-53-7 |
| Molecular Weight (g/mol) | 140.16 |
| MDL Number | MFCD00045998 |
| SMILES | OCCC1=CC=CC(F)=C1 |
| Synonym | 2-3-fluorophenyl ethanol,3-fluorophenethyl alcohol,2-3-fluorophenyl ethan-1-ol,benzeneethanol, 3-fluoro,3-fluorophenethylalcohol,2-3-fluorophenyl ethylalcohol,3-fluorobenzenethanol,3-fluorophenylethanol,3-fluorobenzeneethanol,acmc-209kxl |
| IUPAC Name | 2-(3-fluorophenyl)ethan-1-ol |
| InChI Key | MZNBGEKFZCWVES-UHFFFAOYSA-N |
| Molecular Formula | C8H9FO |
DAPT 97.0+%, TCI America™
CAS: 208255-80-5 Molecular Formula: C23H26F2N2O4 Molecular Weight (g/mol): 432.468 MDL Number: MFCD04974585 InChI Key: DWJXYEABWRJFSP-XOBRGWDASA-N Synonym: dapt,dapt gsi-ix,gamma-secretase inhibitor ix,gsi-ix,insolution gamma-secretase inhibitor ix,s-tert-butyl 2-s-2-2-3,5-difluorophenyl acetamido propanamido-2-phenylacetate,n-n-3,5-difluorophenacetyl-l-alanyl-s-phenylglycine t-butyl ester,tert-butyl 2s-2-2s-2-2-3,5-difluorophenyl acetamido propanamido-2-phenylacetate,tert-butyl 2s-2-2s-2-2-3,5-difluorophenyl acetyl amino propanoyl amino-2-phenylacetate,gsiix PubChem CID: 5311272 ChEBI: CHEBI:86193 IUPAC Name: tert-butyl (2S)-2-[[(2S)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoyl]amino]-2-phenylacetate SMILES: CC(C(=O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2=CC(=CC(=C2)F)F
| PubChem CID | 5311272 |
|---|---|
| CAS | 208255-80-5 |
| Molecular Weight (g/mol) | 432.468 |
| ChEBI | CHEBI:86193 |
| MDL Number | MFCD04974585 |
| SMILES | CC(C(=O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2=CC(=CC(=C2)F)F |
| Synonym | dapt,dapt gsi-ix,gamma-secretase inhibitor ix,gsi-ix,insolution gamma-secretase inhibitor ix,s-tert-butyl 2-s-2-2-3,5-difluorophenyl acetamido propanamido-2-phenylacetate,n-n-3,5-difluorophenacetyl-l-alanyl-s-phenylglycine t-butyl ester,tert-butyl 2s-2-2s-2-2-3,5-difluorophenyl acetamido propanamido-2-phenylacetate,tert-butyl 2s-2-2s-2-2-3,5-difluorophenyl acetyl amino propanoyl amino-2-phenylacetate,gsiix |
| IUPAC Name | tert-butyl (2S)-2-[[(2S)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoyl]amino]-2-phenylacetate |
| InChI Key | DWJXYEABWRJFSP-XOBRGWDASA-N |
| Molecular Formula | C23H26F2N2O4 |
4-Bromobenzohydrazide 97.0+%, TCI America™
CAS: 5933-32-4 Molecular Formula: C7H7BrN2O Molecular Weight (g/mol): 215.05 MDL Number: MFCD00007602 InChI Key: UYIMBYKIIMYFPS-UHFFFAOYSA-N Synonym: 4-bromobenzhydrazide,p-bromobenzhydrazide,4-bromobenzoic hydrazide,p-bromobenzohydrazide,p-bromobenzoic acid hydrazide,4-bromobenzoylhydrazine,4-bromobenzoic acid hydrazide,benzoic acid, 4-bromo-, hydrazide,4-bromo-benzoic acid hydrazide,p-bromobenzoylhydrazine PubChem CID: 22219 IUPAC Name: 4-bromobenzohydrazide SMILES: C1=CC(=CC=C1C(=O)NN)Br
| PubChem CID | 22219 |
|---|---|
| CAS | 5933-32-4 |
| Molecular Weight (g/mol) | 215.05 |
| MDL Number | MFCD00007602 |
| SMILES | C1=CC(=CC=C1C(=O)NN)Br |
| Synonym | 4-bromobenzhydrazide,p-bromobenzhydrazide,4-bromobenzoic hydrazide,p-bromobenzohydrazide,p-bromobenzoic acid hydrazide,4-bromobenzoylhydrazine,4-bromobenzoic acid hydrazide,benzoic acid, 4-bromo-, hydrazide,4-bromo-benzoic acid hydrazide,p-bromobenzoylhydrazine |
| IUPAC Name | 4-bromobenzohydrazide |
| InChI Key | UYIMBYKIIMYFPS-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2O |