Benzene and substituted derivatives
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4-Fluoroaniline, 98%
CAS: 371-40-4 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007829 InChI Key: KRZCOLNOCZKSDF-UHFFFAOYSA-N Synonym: p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline PubChem CID: 9731 ChEBI: CHEBI:28546 IUPAC Name: 4-fluoroaniline SMILES: NC1=CC=C(F)C=C1
| PubChem CID | 9731 |
|---|---|
| CAS | 371-40-4 |
| Molecular Weight (g/mol) | 111.12 |
| ChEBI | CHEBI:28546 |
| MDL Number | MFCD00007829 |
| SMILES | NC1=CC=C(F)C=C1 |
| Synonym | p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline |
| IUPAC Name | 4-fluoroaniline |
| InChI Key | KRZCOLNOCZKSDF-UHFFFAOYSA-N |
| Molecular Formula | C6H6FN |
1-Bromo-3,5-difluorobenzene, 98%
CAS: 461-96-1 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.99 MDL Number: MFCD00010305 InChI Key: JHLKSIOJYMGSMB-UHFFFAOYSA-N Synonym: 3,5-difluorobromobenzene,1-bromo-3,5-difluoro-benzene,1-bromo-3,5-difluoro benzene,benzene, 1-bromo-3,5-difluoro,3,5-difluoro-bromobenzene,pubchem1042,acmc-1ae0k,3,5-difluoro bromobenzene,bromo-3,5-difluorobenzene,3,5-difluorophenyl bromide PubChem CID: 136313 IUPAC Name: 1-bromo-3,5-difluorobenzene SMILES: FC1=CC(Br)=CC(F)=C1
| PubChem CID | 136313 |
|---|---|
| CAS | 461-96-1 |
| Molecular Weight (g/mol) | 192.99 |
| MDL Number | MFCD00010305 |
| SMILES | FC1=CC(Br)=CC(F)=C1 |
| Synonym | 3,5-difluorobromobenzene,1-bromo-3,5-difluoro-benzene,1-bromo-3,5-difluoro benzene,benzene, 1-bromo-3,5-difluoro,3,5-difluoro-bromobenzene,pubchem1042,acmc-1ae0k,3,5-difluoro bromobenzene,bromo-3,5-difluorobenzene,3,5-difluorophenyl bromide |
| IUPAC Name | 1-bromo-3,5-difluorobenzene |
| InChI Key | JHLKSIOJYMGSMB-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF2 |
2,3-Difluorophenylacetic acid, 98%
CAS: 145689-41-4 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00040968 InChI Key: UXSQXUSJGPVOKT-UHFFFAOYSA-N Synonym: 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot PubChem CID: 520772 IUPAC Name: 2-(2,3-difluorophenyl)acetic acid SMILES: C1=CC(=C(C(=C1)F)F)CC(=O)O
| PubChem CID | 520772 |
|---|---|
| CAS | 145689-41-4 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD00040968 |
| SMILES | C1=CC(=C(C(=C1)F)F)CC(=O)O |
| Synonym | 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot |
| IUPAC Name | 2-(2,3-difluorophenyl)acetic acid |
| InChI Key | UXSQXUSJGPVOKT-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
2,3-Difluorotoluene, 97%, Thermo Scientific™
CAS: 3828-49-7 Molecular Formula: C7H6F2 Molecular Weight (g/mol): 128.12 MDL Number: MFCD01631506 InChI Key: ZNEHIDGAPGVZSA-UHFFFAOYSA-N Synonym: 2,3-difluorotoluene,1,2-difluoro-3-methyl-benzene,benzene, 1,2-difluoro-3-methyl,2,3-difluoro methyl benzene,pubchem1610,2,3-difluoro toluene,acmc-209iz4,2.3-difluoro methyl benzene,ksc493c6t PubChem CID: 2774228 IUPAC Name: 1,2-difluoro-3-methylbenzene SMILES: CC1=CC=CC(F)=C1F
| PubChem CID | 2774228 |
|---|---|
| CAS | 3828-49-7 |
| Molecular Weight (g/mol) | 128.12 |
| MDL Number | MFCD01631506 |
| SMILES | CC1=CC=CC(F)=C1F |
| Synonym | 2,3-difluorotoluene,1,2-difluoro-3-methyl-benzene,benzene, 1,2-difluoro-3-methyl,2,3-difluoro methyl benzene,pubchem1610,2,3-difluoro toluene,acmc-209iz4,2.3-difluoro methyl benzene,ksc493c6t |
| IUPAC Name | 1,2-difluoro-3-methylbenzene |
| InChI Key | ZNEHIDGAPGVZSA-UHFFFAOYSA-N |
| Molecular Formula | C7H6F2 |
2,6-Difluorophenylzinc bromide, 0.5M in THF, packaged under Argon in resealable ChemSeal™ bottles
CAS: 1380918-98-8 Molecular Formula: C6H3BrF2Zn Molecular Weight (g/mol): 258.37 MDL Number: MFCD09801448 InChI Key: PYSMUDJGPPCOFC-UHFFFAOYSA-M Synonym: 2,6-difluorophenylzinc bromide,bromo 2,6-difluorophenyl zinc,2,6-difluorophenylzinc bromide solution,2,6-difluorophenylzinc bromide 0.5m in tetrahydrofuran,2,6-difluorophenylzinc bromide solution, 0.5 m in thf,2,6-difluorophenylzinc bromide, 0.5m in tetrahydrofuran PubChem CID: 24722677 IUPAC Name: 2,6-difluorobenzen-1-ide; bromozincylium SMILES: [Zn+]Br.FC1=CC=CC(F)=[C-]1
| PubChem CID | 24722677 |
|---|---|
| CAS | 1380918-98-8 |
| Molecular Weight (g/mol) | 258.37 |
| MDL Number | MFCD09801448 |
| SMILES | [Zn+]Br.FC1=CC=CC(F)=[C-]1 |
| Synonym | 2,6-difluorophenylzinc bromide,bromo 2,6-difluorophenyl zinc,2,6-difluorophenylzinc bromide solution,2,6-difluorophenylzinc bromide 0.5m in tetrahydrofuran,2,6-difluorophenylzinc bromide solution, 0.5 m in thf,2,6-difluorophenylzinc bromide, 0.5m in tetrahydrofuran |
| IUPAC Name | 2,6-difluorobenzen-1-ide; bromozincylium |
| InChI Key | PYSMUDJGPPCOFC-UHFFFAOYSA-M |
| Molecular Formula | C6H3BrF2Zn |
2,5-Difluorobenzene-1,4-diboronic acid bis(pinacol) ester, 96%
CAS: 303006-90-8 Molecular Formula: C18H26B2F2O4 Molecular Weight (g/mol): 366.019 MDL Number: MFCD12407211 InChI Key: PJCSUAIUPWCQRS-UHFFFAOYSA-N Synonym: 2,2'-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid, pinacol ester,2-2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid,pinacol ester,2,2'-2,5-difluoro-p-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,2-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 53216814 IUPAC Name: 2-[2,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)B3OC(C(O3)(C)C)(C)C)F
| PubChem CID | 53216814 |
|---|---|
| CAS | 303006-90-8 |
| Molecular Weight (g/mol) | 366.019 |
| MDL Number | MFCD12407211 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)B3OC(C(O3)(C)C)(C)C)F |
| Synonym | 2,2'-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid, pinacol ester,2-2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid,pinacol ester,2,2'-2,5-difluoro-p-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,2-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-[2,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | PJCSUAIUPWCQRS-UHFFFAOYSA-N |
| Molecular Formula | C18H26B2F2O4 |
2,4-Difluorophenylacetic acid, 99%
CAS: 81228-09-3 Molecular Formula: C8H5F2O2 Molecular Weight (g/mol): 171.12 MDL Number: MFCD00009999 InChI Key: QPKZIGHNRLZBCL-UHFFFAOYSA-M Synonym: 2,4-difluorophenylacetic acid,2-2,4-difluorophenyl acetic acid,benzeneacetic acid, 2,4-difluoro,2,4-difluorophenyl acetic acid,2,4-ddifluorophenylacetic acid,rarechem al bo 0247,2,4-difluoro-phenyl-acetic acid,2,4-difluorobenzeneacetic acid,2,4-difluorophenylaceticacid PubChem CID: 123581 IUPAC Name: 2-(2,4-difluorophenyl)acetic acid SMILES: [O-]C(=O)CC1=CC=C(F)C=C1F
| PubChem CID | 123581 |
|---|---|
| CAS | 81228-09-3 |
| Molecular Weight (g/mol) | 171.12 |
| MDL Number | MFCD00009999 |
| SMILES | [O-]C(=O)CC1=CC=C(F)C=C1F |
| Synonym | 2,4-difluorophenylacetic acid,2-2,4-difluorophenyl acetic acid,benzeneacetic acid, 2,4-difluoro,2,4-difluorophenyl acetic acid,2,4-ddifluorophenylacetic acid,rarechem al bo 0247,2,4-difluoro-phenyl-acetic acid,2,4-difluorobenzeneacetic acid,2,4-difluorophenylaceticacid |
| IUPAC Name | 2-(2,4-difluorophenyl)acetic acid |
| InChI Key | QPKZIGHNRLZBCL-UHFFFAOYSA-M |
| Molecular Formula | C8H5F2O2 |
2-Fluorophenethyl bromide, 97%
CAS: 91319-54-9 Molecular Formula: C8H8BrF Molecular Weight (g/mol): 203.05 InChI Key: FQGDFWIQBCQXPS-UHFFFAOYSA-N Synonym: 2-fluorophenethyl bromide,1-2-bromoethyl-2-fluorobenzene,1-2-bromo-ethyl-2-fluoro-benzene,benzene, 1-2-bromoethyl-2-fluoro,2-2-bromoethyl-1-fluorobenzene,1-2-bromoethyl-2-fluoro-benzene,2-fluorophenyl-ethylbromide,acmc-209wk4,2-fluorophenyl ethyl bromide,2-2-fluorophenyl-ethylbromide PubChem CID: 2756964 IUPAC Name: 1-(2-bromoethyl)-2-fluorobenzene SMILES: C1=CC=C(C(=C1)CCBr)F
| PubChem CID | 2756964 |
|---|---|
| CAS | 91319-54-9 |
| Molecular Weight (g/mol) | 203.05 |
| SMILES | C1=CC=C(C(=C1)CCBr)F |
| Synonym | 2-fluorophenethyl bromide,1-2-bromoethyl-2-fluorobenzene,1-2-bromo-ethyl-2-fluoro-benzene,benzene, 1-2-bromoethyl-2-fluoro,2-2-bromoethyl-1-fluorobenzene,1-2-bromoethyl-2-fluoro-benzene,2-fluorophenyl-ethylbromide,acmc-209wk4,2-fluorophenyl ethyl bromide,2-2-fluorophenyl-ethylbromide |
| IUPAC Name | 1-(2-bromoethyl)-2-fluorobenzene |
| InChI Key | FQGDFWIQBCQXPS-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrF |
Fluconazole, USP, 98-102%, Spectrum™ Chemical
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CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.28 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol SMILES: OC(CN1C=NC=N1)(CN1C=NC=N1)C1=CC=C(F)C=C1F
| CAS | 86386-73-4 |
|---|---|
| Molecular Weight (g/mol) | 306.28 |
| SMILES | OC(CN1C=NC=N1)(CN1C=NC=N1)C1=CC=C(F)C=C1F |
| IUPAC Name | 2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol |
| InChI Key | RFHAOTPXVQNOHP-UHFFFAOYSA-N |
| Molecular Formula | C13H12F2N6O |
4-Bromo-2-fluorotoluene, 99%
CAS: 51436-99-8 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00013551 InChI Key: YZFVUQSAJMLFOZ-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene PubChem CID: 171040 IUPAC Name: 4-bromo-2-fluoro-1-methylbenzene SMILES: CC1=C(C=C(C=C1)Br)F
| PubChem CID | 171040 |
|---|---|
| CAS | 51436-99-8 |
| Molecular Weight (g/mol) | 189.027 |
| MDL Number | MFCD00013551 |
| SMILES | CC1=C(C=C(C=C1)Br)F |
| Synonym | 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene |
| IUPAC Name | 4-bromo-2-fluoro-1-methylbenzene |
| InChI Key | YZFVUQSAJMLFOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrF |
3-Fluoro-2-methylbenzeneboronic acid, 98%, Thermo Scientific Chemicals
CAS: 163517-61-1 Molecular Formula: C7H8BFO2 Molecular Weight (g/mol): 153.947 MDL Number: MFCD07368679 InChI Key: NYBIUWJUWTUGFV-UHFFFAOYSA-N Synonym: 3-fluoro-2-methylphenyl boronic acid,2-methyl-3-fluoro-phenylboronic acid,3-fluoro-2-methylbenzeneboronic acid,3-fluoro-o-tolylboronic acid,boronic acid, 3-fluoro-2-methylphenyl,boronic acid,b-3-fluoro-2-methylphenyl,3-fluoro-2-methyl-phenyl boronic acid,2-borono-6-fluorotoluene,acmc-1c5qk,2-methyl-3-fluorophenylboronic acid PubChem CID: 2783191 IUPAC Name: (3-fluoro-2-methylphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)F)C)(O)O
| PubChem CID | 2783191 |
|---|---|
| CAS | 163517-61-1 |
| Molecular Weight (g/mol) | 153.947 |
| MDL Number | MFCD07368679 |
| SMILES | B(C1=C(C(=CC=C1)F)C)(O)O |
| Synonym | 3-fluoro-2-methylphenyl boronic acid,2-methyl-3-fluoro-phenylboronic acid,3-fluoro-2-methylbenzeneboronic acid,3-fluoro-o-tolylboronic acid,boronic acid, 3-fluoro-2-methylphenyl,boronic acid,b-3-fluoro-2-methylphenyl,3-fluoro-2-methyl-phenyl boronic acid,2-borono-6-fluorotoluene,acmc-1c5qk,2-methyl-3-fluorophenylboronic acid |
| IUPAC Name | (3-fluoro-2-methylphenyl)boronic acid |
| InChI Key | NYBIUWJUWTUGFV-UHFFFAOYSA-N |
| Molecular Formula | C7H8BFO2 |
4-(Trifluoromethylsulfonyl)benzonitrile, 97+%
CAS: 312-21-0 Molecular Formula: C8H4F3NO2S Molecular Weight (g/mol): 235.18 MDL Number: MFCD01631631 InChI Key: UHCGSMMNICMDIX-UHFFFAOYSA-N Synonym: 4-trifluoromethylsulfonyl benzonitrile,4-trifluoromethyl sulfonyl benzonitrile,4-trifluoromethanesulfonyl benzonitrile,4-trifluoromethanesulfonylbenzonitrile,4-trifluoromethyl sulfonyl benzenecarbonitrile,acmc-1clj3,4-trifluoromethanesulphonylbenzonitrile,4-trifluoromethylsulfonyl benzonitril PubChem CID: 2777824 IUPAC Name: 4-(trifluoromethylsulfonyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)S(=O)(=O)C(F)(F)F
| PubChem CID | 2777824 |
|---|---|
| CAS | 312-21-0 |
| Molecular Weight (g/mol) | 235.18 |
| MDL Number | MFCD01631631 |
| SMILES | C1=CC(=CC=C1C#N)S(=O)(=O)C(F)(F)F |
| Synonym | 4-trifluoromethylsulfonyl benzonitrile,4-trifluoromethyl sulfonyl benzonitrile,4-trifluoromethanesulfonyl benzonitrile,4-trifluoromethanesulfonylbenzonitrile,4-trifluoromethyl sulfonyl benzenecarbonitrile,acmc-1clj3,4-trifluoromethanesulphonylbenzonitrile,4-trifluoromethylsulfonyl benzonitril |
| IUPAC Name | 4-(trifluoromethylsulfonyl)benzonitrile |
| InChI Key | UHCGSMMNICMDIX-UHFFFAOYSA-N |
| Molecular Formula | C8H4F3NO2S |
Phenyl trans-beta-styryl sulfone, 96%
CAS: 16212-06-9 Molecular Formula: C14H12O2S Molecular Weight (g/mol): 244.308 MDL Number: MFCD00159177 InChI Key: DNMCCXFLTURVLK-VAWYXSNFSA-N Synonym: phenyl trans-styryl sulfone,phenyl styryl sulfone,sulfone, phenyl styryl,phenyl trans-styryl sulphone,phenyl 2-phenylvinyl sulfone,benzene, 2-phenylethenyl sulfonyl,e-2-benzenesulfonyl ethenyl benzene,1e-2-phenylvinyl sulfonyl benzene,styrylsulfonylbenzene,e-2-phenylethenyl sulphonylbenzene PubChem CID: 736143 IUPAC Name: [(E)-2-(benzenesulfonyl)ethenyl]benzene SMILES: C1=CC=C(C=C1)C=CS(=O)(=O)C2=CC=CC=C2
| PubChem CID | 736143 |
|---|---|
| CAS | 16212-06-9 |
| Molecular Weight (g/mol) | 244.308 |
| MDL Number | MFCD00159177 |
| SMILES | C1=CC=C(C=C1)C=CS(=O)(=O)C2=CC=CC=C2 |
| Synonym | phenyl trans-styryl sulfone,phenyl styryl sulfone,sulfone, phenyl styryl,phenyl trans-styryl sulphone,phenyl 2-phenylvinyl sulfone,benzene, 2-phenylethenyl sulfonyl,e-2-benzenesulfonyl ethenyl benzene,1e-2-phenylvinyl sulfonyl benzene,styrylsulfonylbenzene,e-2-phenylethenyl sulphonylbenzene |
| IUPAC Name | [(E)-2-(benzenesulfonyl)ethenyl]benzene |
| InChI Key | DNMCCXFLTURVLK-VAWYXSNFSA-N |
| Molecular Formula | C14H12O2S |
Methyl phenylsulfonylacetate, 98%
CAS: 34097-60-4 Molecular Formula: C9H10O4S Molecular Weight (g/mol): 214.235 MDL Number: MFCD00007555 InChI Key: NLEAIFBNKPYTGN-UHFFFAOYSA-N PubChem CID: 555619 IUPAC Name: methyl 2-(benzenesulfonyl)acetate SMILES: COC(=O)CS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 555619 |
|---|---|
| CAS | 34097-60-4 |
| Molecular Weight (g/mol) | 214.235 |
| MDL Number | MFCD00007555 |
| SMILES | COC(=O)CS(=O)(=O)C1=CC=CC=C1 |
| IUPAC Name | methyl 2-(benzenesulfonyl)acetate |
| InChI Key | NLEAIFBNKPYTGN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4S |
2-Fluoro-5-methylsulphonylnitrobenzene, 95%, Thermo Scientific™
CAS: 453-72-5 Molecular Formula: C7H6FNO4S Molecular Weight (g/mol): 219.19 MDL Number: MFCD00025066 InChI Key: OUSNDSFSTBZESM-UHFFFAOYSA-N Synonym: 4-methylsulfonyl-2-nitrofluorobenzene,1-fluoro-4-methylsulfonyl-2-nitrobenzene,1-fluoro-4-methanesulfonyl-2-nitrobenzene,2-fluoro-5-methyl sulfonyl nitrobenzene,2-fluoro-5-methylsulphonylnitrobenzene,4-fluoro-3-nitrophenyl methyl sulfone,benzene,1-fluoro-4-methylsulfonyl-2-nitro,2-fluoro-5-methylsulfonylnitrobenzene,2-fluoro-5-methylsulphonyl nitrobenzene,1-fluoro-4-methylsulfonyl-2-nitro-benzene PubChem CID: 313137 IUPAC Name: 1-fluoro-4-methanesulfonyl-2-nitrobenzene SMILES: CS(=O)(=O)C1=CC=C(F)C(=C1)[N+]([O-])=O
| PubChem CID | 313137 |
|---|---|
| CAS | 453-72-5 |
| Molecular Weight (g/mol) | 219.19 |
| MDL Number | MFCD00025066 |
| SMILES | CS(=O)(=O)C1=CC=C(F)C(=C1)[N+]([O-])=O |
| Synonym | 4-methylsulfonyl-2-nitrofluorobenzene,1-fluoro-4-methylsulfonyl-2-nitrobenzene,1-fluoro-4-methanesulfonyl-2-nitrobenzene,2-fluoro-5-methyl sulfonyl nitrobenzene,2-fluoro-5-methylsulphonylnitrobenzene,4-fluoro-3-nitrophenyl methyl sulfone,benzene,1-fluoro-4-methylsulfonyl-2-nitro,2-fluoro-5-methylsulfonylnitrobenzene,2-fluoro-5-methylsulphonyl nitrobenzene,1-fluoro-4-methylsulfonyl-2-nitro-benzene |
| IUPAC Name | 1-fluoro-4-methanesulfonyl-2-nitrobenzene |
| InChI Key | OUSNDSFSTBZESM-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO4S |