Benzenoids
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2,4-Dichlorobenzoyl Chloride 97.0+%, TCI America™
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CAS: 89-75-8 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00000661 InChI Key: CEOCVKWBUWKBKA-UHFFFAOYSA-N Synonym: benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p PubChem CID: 66645 IUPAC Name: 2,4-dichlorobenzoyl chloride SMILES: ClC(=O)C1=CC=C(Cl)C=C1Cl
| PubChem CID | 66645 |
|---|---|
| CAS | 89-75-8 |
| Molecular Weight (g/mol) | 209.45 |
| MDL Number | MFCD00000661 |
| SMILES | ClC(=O)C1=CC=C(Cl)C=C1Cl |
| Synonym | benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p |
| IUPAC Name | 2,4-dichlorobenzoyl chloride |
| InChI Key | CEOCVKWBUWKBKA-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl3O |
2-Iodophenyl Trifluoromethanesulfonate 98.0+%, TCI America™
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CAS: 129112-26-1 Molecular Formula: C7H4F3IO3S Molecular Weight (g/mol): 352.07 MDL Number: MFCD07784326 InChI Key: AXIDYNSWXPNBLG-UHFFFAOYSA-N Synonym: Trifluoromethanesulfonic Acid 2-Iodophenyl Ester, 2-Iodophenyl Triflate PubChem CID: 10784152 IUPAC Name: 2-iodophenyl trifluoromethanesulfonate SMILES: FC(F)(F)S(=O)(=O)OC1=CC=CC=C1I
| PubChem CID | 10784152 |
|---|---|
| CAS | 129112-26-1 |
| Molecular Weight (g/mol) | 352.07 |
| MDL Number | MFCD07784326 |
| SMILES | FC(F)(F)S(=O)(=O)OC1=CC=CC=C1I |
| Synonym | Trifluoromethanesulfonic Acid 2-Iodophenyl Ester, 2-Iodophenyl Triflate |
| IUPAC Name | 2-iodophenyl trifluoromethanesulfonate |
| InChI Key | AXIDYNSWXPNBLG-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3IO3S |
Sodium 1-Naphthol-4-sulfonate 85.0+%, TCI America™
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CAS: 6099-57-6 Molecular Formula: C10H7NaO4S Molecular Weight (g/mol): 246.212 MDL Number: MFCD00021518 InChI Key: IAAKNVCARVEIFS-UHFFFAOYSA-M Synonym: 1-naphthol-4-sulfonic acid sodium salt,sodium naphthol sulfonate,sodium 1-naphthol-4-sulfonate,sodium 4-hydroxynaphthalene-1-sulfonate,4-hydroxy-1-naphthalenesulfonic acid monosodium salt,sodium 4-hydroxy-1-naphthalenesulfonate,1-naphthalenesulfonic acid, 4-hydroxy-, monosodium salt,1-naphthalenesulfonic acid, 4-hydroxy-, sodium salt 1:1,4-hydroxy-1-naphthalenesulfonic acid sodium salt,84-87-7 parent PubChem CID: 4626046 IUPAC Name: sodium;4-hydroxynaphthalene-1-sulfonate SMILES: C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])O.[Na+]
| PubChem CID | 4626046 |
|---|---|
| CAS | 6099-57-6 |
| Molecular Weight (g/mol) | 246.212 |
| MDL Number | MFCD00021518 |
| SMILES | C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])O.[Na+] |
| Synonym | 1-naphthol-4-sulfonic acid sodium salt,sodium naphthol sulfonate,sodium 1-naphthol-4-sulfonate,sodium 4-hydroxynaphthalene-1-sulfonate,4-hydroxy-1-naphthalenesulfonic acid monosodium salt,sodium 4-hydroxy-1-naphthalenesulfonate,1-naphthalenesulfonic acid, 4-hydroxy-, monosodium salt,1-naphthalenesulfonic acid, 4-hydroxy-, sodium salt 1:1,4-hydroxy-1-naphthalenesulfonic acid sodium salt,84-87-7 parent |
| IUPAC Name | sodium;4-hydroxynaphthalene-1-sulfonate |
| InChI Key | IAAKNVCARVEIFS-UHFFFAOYSA-M |
| Molecular Formula | C10H7NaO4S |
2,3,5,6-Tetrafluoro-4-(trifluoromethyl)benzenethiol 97.0+%, TCI America™
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CAS: 651-84-3 Molecular Formula: C7HF7S Molecular Weight (g/mol): 250.13 MDL Number: MFCD00191594 InChI Key: BXMOMKVOHOSVJH-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-4-trifluoromethyl benzenethiol,4-trifluoromethyl-2,3,5,6-tetrafluorothiophenol,4-trifluoromethyl tetrafluorothiophenol,2,3,5,6-tetrafluoro-4-trifluoromethyl benzene-1-thiol,benzenethiol,2,3,5,6-tetrafluoro-4-trifluoromethyl,acmc-209npo,tetrafluoro-4-trifluoromethyl thiophenol,2,3,5,6-tetra-fluoro-4-trifluoromethylbenzenethiol,4-mercapto-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene PubChem CID: 619538 IUPAC Name: 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene-1-thiol SMILES: FC1=C(F)C(=C(F)C(F)=C1S)C(F)(F)F
| PubChem CID | 619538 |
|---|---|
| CAS | 651-84-3 |
| Molecular Weight (g/mol) | 250.13 |
| MDL Number | MFCD00191594 |
| SMILES | FC1=C(F)C(=C(F)C(F)=C1S)C(F)(F)F |
| Synonym | 2,3,5,6-tetrafluoro-4-trifluoromethyl benzenethiol,4-trifluoromethyl-2,3,5,6-tetrafluorothiophenol,4-trifluoromethyl tetrafluorothiophenol,2,3,5,6-tetrafluoro-4-trifluoromethyl benzene-1-thiol,benzenethiol,2,3,5,6-tetrafluoro-4-trifluoromethyl,acmc-209npo,tetrafluoro-4-trifluoromethyl thiophenol,2,3,5,6-tetra-fluoro-4-trifluoromethylbenzenethiol,4-mercapto-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene |
| IUPAC Name | 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene-1-thiol |
| InChI Key | BXMOMKVOHOSVJH-UHFFFAOYSA-N |
| Molecular Formula | C7HF7S |
1,3-Bis[4-(trifluoromethyl)phenyl]urea 98.0+%, TCI America™
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CAS: 1960-88-9 Molecular Formula: C15H10F6N2O Molecular Weight (g/mol): 348.248 MDL Number: MFCD01908917 InChI Key: PEXQIAHZLFTVJU-UHFFFAOYSA-N Synonym: 1,3-bis 4-trifluoromethyl phenyl urea,maybridge4_001077,1,3-bis 4-trifluoromethylphenyl urea,n,n'-bis-4-trifluoromethylphenyl-urea,urea, n,n'-bis 4-trifluoromethyl phenyl PubChem CID: 472928 IUPAC Name: 1,3-bis[4-(trifluoromethyl)phenyl]urea SMILES: C1=CC(=CC=C1C(F)(F)F)NC(=O)NC2=CC=C(C=C2)C(F)(F)F
| PubChem CID | 472928 |
|---|---|
| CAS | 1960-88-9 |
| Molecular Weight (g/mol) | 348.248 |
| MDL Number | MFCD01908917 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)NC(=O)NC2=CC=C(C=C2)C(F)(F)F |
| Synonym | 1,3-bis 4-trifluoromethyl phenyl urea,maybridge4_001077,1,3-bis 4-trifluoromethylphenyl urea,n,n'-bis-4-trifluoromethylphenyl-urea,urea, n,n'-bis 4-trifluoromethyl phenyl |
| IUPAC Name | 1,3-bis[4-(trifluoromethyl)phenyl]urea |
| InChI Key | PEXQIAHZLFTVJU-UHFFFAOYSA-N |
| Molecular Formula | C15H10F6N2O |
4-(4-Hydroxyphenyl)thiomorpholine 1,1-Dioxide 98.0+%, TCI America™
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CAS: 103661-13-8 Molecular Formula: C10H13NO3S Molecular Weight (g/mol): 227.28 MDL Number: MFCD06797109 InChI Key: NSHOLIWPDBJMPT-UHFFFAOYSA-N Synonym: 4-(1,1-Dioxothiomorpholino)phenol, 4-Thiomorpholinophenol 1′C,1′C-Dioxide PubChem CID: 21845223 IUPAC Name: 4-(4-hydroxyphenyl)-1λ⁶-thiomorpholine-1,1-dione SMILES: OC1=CC=C(C=C1)N1CCS(=O)(=O)CC1
| PubChem CID | 21845223 |
|---|---|
| CAS | 103661-13-8 |
| Molecular Weight (g/mol) | 227.28 |
| MDL Number | MFCD06797109 |
| SMILES | OC1=CC=C(C=C1)N1CCS(=O)(=O)CC1 |
| Synonym | 4-(1,1-Dioxothiomorpholino)phenol, 4-Thiomorpholinophenol 1′C,1′C-Dioxide |
| IUPAC Name | 4-(4-hydroxyphenyl)-1λ⁶-thiomorpholine-1,1-dione |
| InChI Key | NSHOLIWPDBJMPT-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO3S |
2-(Trifluoromethyl)benzenethiol 97.0+%, TCI America™
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CAS: 13333-97-6 Molecular Formula: C7H5F3S Molecular Weight (g/mol): 178.172 MDL Number: MFCD00068896 InChI Key: XVGQHRKNXSUPEF-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzenethiol,2-trifluoromethyl thiophenol,2-trifluoromethylthiophenol,2-trifluoromethyl benzene-1-thiol,2-mercaptobenzotrifluoride,pubchem6860,acmc-209brx,trifluoromethyl thiophenol,2trifluoromethylbenzenethiol PubChem CID: 2777889 IUPAC Name: 2-(trifluoromethyl)benzenethiol SMILES: C1=CC=C(C(=C1)C(F)(F)F)S
| PubChem CID | 2777889 |
|---|---|
| CAS | 13333-97-6 |
| Molecular Weight (g/mol) | 178.172 |
| MDL Number | MFCD00068896 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)S |
| Synonym | 2-trifluoromethyl benzenethiol,2-trifluoromethyl thiophenol,2-trifluoromethylthiophenol,2-trifluoromethyl benzene-1-thiol,2-mercaptobenzotrifluoride,pubchem6860,acmc-209brx,trifluoromethyl thiophenol,2trifluoromethylbenzenethiol |
| IUPAC Name | 2-(trifluoromethyl)benzenethiol |
| InChI Key | XVGQHRKNXSUPEF-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3S |
5-Iodosalicylic Acid 98.0+%, TCI America™
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CAS: 119-30-2 Molecular Formula: C7H5IO3 Molecular Weight (g/mol): 264.018 MDL Number: MFCD00002458 InChI Key: SWDNKOFGNPGRPI-UHFFFAOYSA-N Synonym: 5-iodosalicylic acid,benzoic acid, 2-hydroxy-5-iodo,salicylic acid, 5-iodo,5-iodo-2-hydroxybenzoic acid,2-hydroxy-5-iodo-benzoic acid,rarechem al be 0824,labotest-bb lt00454718,5-jod-salicylsaure,5-iodosalicylicacid,5-iodo-salicylicaci PubChem CID: 8388 IUPAC Name: 2-hydroxy-5-iodobenzoic acid SMILES: C1=CC(=C(C=C1I)C(=O)O)O
| PubChem CID | 8388 |
|---|---|
| CAS | 119-30-2 |
| Molecular Weight (g/mol) | 264.018 |
| MDL Number | MFCD00002458 |
| SMILES | C1=CC(=C(C=C1I)C(=O)O)O |
| Synonym | 5-iodosalicylic acid,benzoic acid, 2-hydroxy-5-iodo,salicylic acid, 5-iodo,5-iodo-2-hydroxybenzoic acid,2-hydroxy-5-iodo-benzoic acid,rarechem al be 0824,labotest-bb lt00454718,5-jod-salicylsaure,5-iodosalicylicacid,5-iodo-salicylicaci |
| IUPAC Name | 2-hydroxy-5-iodobenzoic acid |
| InChI Key | SWDNKOFGNPGRPI-UHFFFAOYSA-N |
| Molecular Formula | C7H5IO3 |
2-Isonitrosopropiophenone 98.0+%, TCI America™
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CAS: 119-51-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00002115 InChI Key: YPINLRNGSGGJJT-JXMROGBWSA-N Synonym: 1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone PubChem CID: 9566063 IUPAC Name: (2E)-2-(N-hydroxyimino)-1-phenylpropan-1-one SMILES: C\C(=N/O)C(=O)C1=CC=CC=C1
| PubChem CID | 9566063 |
|---|---|
| CAS | 119-51-7 |
| Molecular Weight (g/mol) | 163.18 |
| MDL Number | MFCD00002115 |
| SMILES | C\C(=N/O)C(=O)C1=CC=CC=C1 |
| Synonym | 1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone |
| IUPAC Name | (2E)-2-(N-hydroxyimino)-1-phenylpropan-1-one |
| InChI Key | YPINLRNGSGGJJT-JXMROGBWSA-N |
| Molecular Formula | C9H9NO2 |
4-Methoxyphenethyl Alcohol 98.0+%, TCI America™
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CAS: 702-23-8 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00002900 InChI Key: AUWDOZOUJWEPBA-UHFFFAOYSA-N Synonym: 2-4-methoxyphenyl ethanol,4-methoxyphenethyl alcohol,4-methoxybenzeneethanol,benzeneethanol, 4-methoxy,p-methoxyphenethyl alcohol,2-4-methoxyphenyl ethan-1-ol,unii-3mwl5nze9k,3mwl5nze9k,4-2-hydroxyethyl anisole,2-4-methoxyphenyl-ethanol PubChem CID: 69705 IUPAC Name: 2-(4-methoxyphenyl)ethanol SMILES: COC1=CC=C(C=C1)CCO
| PubChem CID | 69705 |
|---|---|
| CAS | 702-23-8 |
| Molecular Weight (g/mol) | 152.193 |
| MDL Number | MFCD00002900 |
| SMILES | COC1=CC=C(C=C1)CCO |
| Synonym | 2-4-methoxyphenyl ethanol,4-methoxyphenethyl alcohol,4-methoxybenzeneethanol,benzeneethanol, 4-methoxy,p-methoxyphenethyl alcohol,2-4-methoxyphenyl ethan-1-ol,unii-3mwl5nze9k,3mwl5nze9k,4-2-hydroxyethyl anisole,2-4-methoxyphenyl-ethanol |
| IUPAC Name | 2-(4-methoxyphenyl)ethanol |
| InChI Key | AUWDOZOUJWEPBA-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
3,5-Dimethoxystilbene 98.0+%, TCI America™
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CAS: 78916-49-1 Molecular Formula: C16H16O2 Molecular Weight (g/mol): 240.30 MDL Number: MFCD00210545 InChI Key: BIYGTLDPTJMNET-CMDGGOBGSA-N PubChem CID: 5316874 IUPAC Name: 1,3-dimethoxy-5-[(1E)-2-phenylethenyl]benzene SMILES: COC1=CC(\C=C\C2=CC=CC=C2)=CC(OC)=C1
| PubChem CID | 5316874 |
|---|---|
| CAS | 78916-49-1 |
| Molecular Weight (g/mol) | 240.30 |
| MDL Number | MFCD00210545 |
| SMILES | COC1=CC(\C=C\C2=CC=CC=C2)=CC(OC)=C1 |
| IUPAC Name | 1,3-dimethoxy-5-[(1E)-2-phenylethenyl]benzene |
| InChI Key | BIYGTLDPTJMNET-CMDGGOBGSA-N |
| Molecular Formula | C16H16O2 |
2,6-Dimethoxy-4-methylphenol 97.0+%, TCI America™
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CAS: 6638-05-7 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00017289 InChI Key: ZFBNNSOJNZBLLS-UHFFFAOYSA-N Synonym: 4-methyl-2,6-dimethoxyphenol,4-methylsyringol,2,6-dimethoxy-p-cresol,phenol, 2,6-dimethoxy-4-methyl,p-cresol, 2,6-dimethoxy,3,5-dimethoxy-4-hydroxytoluene,4-hydroxy-3,5-dimethoxytoluene,unii-fjj5mye75w,fjj5mye75w,2,6-dimethoxy-4-methyl-phenol PubChem CID: 240925 IUPAC Name: 2,6-dimethoxy-4-methylphenol SMILES: CC1=CC(=C(C(=C1)OC)O)OC
| PubChem CID | 240925 |
|---|---|
| CAS | 6638-05-7 |
| Molecular Weight (g/mol) | 168.19 |
| MDL Number | MFCD00017289 |
| SMILES | CC1=CC(=C(C(=C1)OC)O)OC |
| Synonym | 4-methyl-2,6-dimethoxyphenol,4-methylsyringol,2,6-dimethoxy-p-cresol,phenol, 2,6-dimethoxy-4-methyl,p-cresol, 2,6-dimethoxy,3,5-dimethoxy-4-hydroxytoluene,4-hydroxy-3,5-dimethoxytoluene,unii-fjj5mye75w,fjj5mye75w,2,6-dimethoxy-4-methyl-phenol |
| IUPAC Name | 2,6-dimethoxy-4-methylphenol |
| InChI Key | ZFBNNSOJNZBLLS-UHFFFAOYSA-N |
| Molecular Formula | C9H12O3 |
Benzenesulfonyl Isocyanate 97.0+%, TCI America™
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CAS: 2845-62-7 Molecular Formula: C7H5NO3S Molecular Weight (g/mol): 183.181 MDL Number: MFCD00007546 InChI Key: UJYAZVSPFMJCLW-UHFFFAOYSA-N Synonym: benzenesulfonyl isocyanate,phenylsulphonyl isocyanate,phenylsulfonylisocyanate,benzenesulfonylisocyanate,phenylsulfonyl isocyanate,benzenesulphonylisocyanate,phenyl sulfonyl isocyanate,acmc-1clf4,benzene sulfonyl isocyanate,phenyl sulphonyl isocyanate PubChem CID: 76096 IUPAC Name: N-(oxomethylidene)benzenesulfonamide SMILES: C1=CC=C(C=C1)S(=O)(=O)N=C=O
| PubChem CID | 76096 |
|---|---|
| CAS | 2845-62-7 |
| Molecular Weight (g/mol) | 183.181 |
| MDL Number | MFCD00007546 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N=C=O |
| Synonym | benzenesulfonyl isocyanate,phenylsulphonyl isocyanate,phenylsulfonylisocyanate,benzenesulfonylisocyanate,phenylsulfonyl isocyanate,benzenesulphonylisocyanate,phenyl sulfonyl isocyanate,acmc-1clf4,benzene sulfonyl isocyanate,phenyl sulphonyl isocyanate |
| IUPAC Name | N-(oxomethylidene)benzenesulfonamide |
| InChI Key | UJYAZVSPFMJCLW-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO3S |
(S)-Glycidyl Trityl Ether 98.0+%, TCI America™
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CAS: 129940-50-7 Molecular Formula: C22H20O2 Molecular Weight (g/mol): 316.4 MDL Number: MFCD00273373 InChI Key: XFSXUCMYFWZRAF-NRFANRHFSA-N Synonym: s---trityl glycidyl ether,s-2-trityloxy methyl oxirane,s-trityl glycidyl ether,s---glycidyl trityl ether,s-glycidyl trityl ether,2s-2-trityloxymethyl oxirane,s-tritylglycidylether,s-2-triphenylmethoxymethyl oxirane,s---glycidyl triphenylmethyl ether,s-glycidyl triphenylmethyl ether PubChem CID: 7168113 IUPAC Name: (2S)-2-(trityloxymethyl)oxirane SMILES: C1C(O1)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
| PubChem CID | 7168113 |
|---|---|
| CAS | 129940-50-7 |
| Molecular Weight (g/mol) | 316.4 |
| MDL Number | MFCD00273373 |
| SMILES | C1C(O1)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4 |
| Synonym | s---trityl glycidyl ether,s-2-trityloxy methyl oxirane,s-trityl glycidyl ether,s---glycidyl trityl ether,s-glycidyl trityl ether,2s-2-trityloxymethyl oxirane,s-tritylglycidylether,s-2-triphenylmethoxymethyl oxirane,s---glycidyl triphenylmethyl ether,s-glycidyl triphenylmethyl ether |
| IUPAC Name | (2S)-2-(trityloxymethyl)oxirane |
| InChI Key | XFSXUCMYFWZRAF-NRFANRHFSA-N |
| Molecular Formula | C22H20O2 |
Fluoromethyl Phenyl Sulfone 98.0+%, TCI America™
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CAS: 20808-12-2 Molecular Formula: C7H7FO2S Molecular Weight (g/mol): 174.189 MDL Number: MFCD00191650 InChI Key: DENHPZASLKBBHA-UHFFFAOYSA-N Synonym: Fluoromethylsulfonylbenzene PubChem CID: 2759036 IUPAC Name: fluoromethylsulfonylbenzene SMILES: C1=CC=C(C=C1)S(=O)(=O)CF
| PubChem CID | 2759036 |
|---|---|
| CAS | 20808-12-2 |
| Molecular Weight (g/mol) | 174.189 |
| MDL Number | MFCD00191650 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CF |
| Synonym | Fluoromethylsulfonylbenzene |
| IUPAC Name | fluoromethylsulfonylbenzene |
| InChI Key | DENHPZASLKBBHA-UHFFFAOYSA-N |
| Molecular Formula | C7H7FO2S |