
Organooxygen compounds
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2-Hydroxy-2-(trifluoromethyl)propionitrile 96.0+%, TCI America™
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CAS: 335-08-0 Molecular Formula: C4H4F3NO Molecular Weight (g/mol): 139.077 MDL Number: MFCD00040885 InChI Key: XDCMNDCKYSQKAX-UHFFFAOYSA-N Synonym: 1,1,1-trifluoroacetone cyanohydrin,2-cyano-1,1,1-trifluoro-2-propanol,2-hydroxy-2-trifluoromethyl propionitrile,propanenitrile, 3,3,3-trifluoro-2-hydroxy-2-methyl,2-trifluoromethyl lactonitrile,trifluoroacetone cyanohydrin,lactonitrile, 2-trifluoromethyl,3-trifluoro-a-hydroxyisobutyronitrile,lactonitrile,3,3-trifluoro-2-methyl,2-cyano-1,1,1-trifluoropropan-2-ol PubChem CID: 274400 IUPAC Name: 3,3,3-trifluoro-2-hydroxy-2-methylpropanenitrile SMILES: CC(C#N)(C(F)(F)F)O
PubChem CID | 274400 |
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CAS | 335-08-0 |
Molecular Weight (g/mol) | 139.077 |
MDL Number | MFCD00040885 |
SMILES | CC(C#N)(C(F)(F)F)O |
Synonym | 1,1,1-trifluoroacetone cyanohydrin,2-cyano-1,1,1-trifluoro-2-propanol,2-hydroxy-2-trifluoromethyl propionitrile,propanenitrile, 3,3,3-trifluoro-2-hydroxy-2-methyl,2-trifluoromethyl lactonitrile,trifluoroacetone cyanohydrin,lactonitrile, 2-trifluoromethyl,3-trifluoro-a-hydroxyisobutyronitrile,lactonitrile,3,3-trifluoro-2-methyl,2-cyano-1,1,1-trifluoropropan-2-ol |
IUPAC Name | 3,3,3-trifluoro-2-hydroxy-2-methylpropanenitrile |
InChI Key | XDCMNDCKYSQKAX-UHFFFAOYSA-N |
Molecular Formula | C4H4F3NO |
1-Heptadecanol 97.0+%, TCI America™
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CAS: 1454-85-9 Molecular Formula: C17H36O Molecular Weight (g/mol): 256.474 MDL Number: MFCD00002822 InChI Key: GOQYKNQRPGWPLP-UHFFFAOYSA-N Synonym: 1-heptadecanol,heptadecyl alcohol,heptadecanol,n-heptadecanol,unii-n3il85tmcx,1-hydroxyheptadecane,alcohols, c16-18,n3il85tmcx,heptadecanol mixed primary isomers,n-heptadecanol-1 PubChem CID: 15076 ChEBI: CHEBI:77470 IUPAC Name: heptadecan-1-ol SMILES: CCCCCCCCCCCCCCCCCO
PubChem CID | 15076 |
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CAS | 1454-85-9 |
Molecular Weight (g/mol) | 256.474 |
ChEBI | CHEBI:77470 |
MDL Number | MFCD00002822 |
SMILES | CCCCCCCCCCCCCCCCCO |
Synonym | 1-heptadecanol,heptadecyl alcohol,heptadecanol,n-heptadecanol,unii-n3il85tmcx,1-hydroxyheptadecane,alcohols, c16-18,n3il85tmcx,heptadecanol mixed primary isomers,n-heptadecanol-1 |
IUPAC Name | heptadecan-1-ol |
InChI Key | GOQYKNQRPGWPLP-UHFFFAOYSA-N |
Molecular Formula | C17H36O |
Hexahydroxybenzene 98.0+%, TCI America™
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CAS: 608-80-0 Molecular Formula: C6H6O6 Molecular Weight (g/mol): 174.11 MDL Number: MFCD00013966 InChI Key: VWPUAXALDFFXJW-UHFFFAOYSA-N PubChem CID: 69102 IUPAC Name: benzene-1,2,3,4,5,6-hexol SMILES: OC1=C(O)C(O)=C(O)C(O)=C1O
PubChem CID | 69102 |
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CAS | 608-80-0 |
Molecular Weight (g/mol) | 174.11 |
MDL Number | MFCD00013966 |
SMILES | OC1=C(O)C(O)=C(O)C(O)=C1O |
IUPAC Name | benzene-1,2,3,4,5,6-hexol |
InChI Key | VWPUAXALDFFXJW-UHFFFAOYSA-N |
Molecular Formula | C6H6O6 |
3'-Fluoroacetophenone 97.0+%, TCI America™
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CAS: 455-36-7 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD00000338 InChI Key: HCEKGPAHZCYRBZ-UHFFFAOYSA-N Synonym: 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene PubChem CID: 9967 IUPAC Name: 1-(3-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=CC(F)=C1
PubChem CID | 9967 |
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CAS | 455-36-7 |
Molecular Weight (g/mol) | 138.14 |
MDL Number | MFCD00000338 |
SMILES | CC(=O)C1=CC=CC(F)=C1 |
Synonym | 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene |
IUPAC Name | 1-(3-fluorophenyl)ethan-1-one |
InChI Key | HCEKGPAHZCYRBZ-UHFFFAOYSA-N |
Molecular Formula | C8H7FO |
6-Fluoro-2-methyl-4-chromanone 97.0+%, TCI America™
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CAS: 88754-96-5 Molecular Formula: C10H9FO2 Molecular Weight (g/mol): 180.18 MDL Number: MFCD00059072 InChI Key: RPAIBTVEPAACRP-UHFFFAOYNA-N PubChem CID: 2737390 IUPAC Name: 6-fluoro-2-methyl-3,4-dihydro-2H-1-benzopyran-4-one SMILES: CC1CC(=O)C2=C(O1)C=CC(F)=C2
PubChem CID | 2737390 |
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CAS | 88754-96-5 |
Molecular Weight (g/mol) | 180.18 |
MDL Number | MFCD00059072 |
SMILES | CC1CC(=O)C2=C(O1)C=CC(F)=C2 |
IUPAC Name | 6-fluoro-2-methyl-3,4-dihydro-2H-1-benzopyran-4-one |
InChI Key | RPAIBTVEPAACRP-UHFFFAOYNA-N |
Molecular Formula | C10H9FO2 |
2-Formylthiazole 97.0+%, TCI America™
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CAS: 10200-59-6 Molecular Formula: C4H3NOS Molecular Weight (g/mol): 113.134 MDL Number: MFCD00142924 InChI Key: ZGTFNNUASMWGTM-UHFFFAOYSA-N Synonym: 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 PubChem CID: 2734903 ChEBI: CHEBI:43623 IUPAC Name: 1,3-thiazole-2-carbaldehyde SMILES: C1=CSC(=N1)C=O
PubChem CID | 2734903 |
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CAS | 10200-59-6 |
Molecular Weight (g/mol) | 113.134 |
ChEBI | CHEBI:43623 |
MDL Number | MFCD00142924 |
SMILES | C1=CSC(=N1)C=O |
Synonym | 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 |
IUPAC Name | 1,3-thiazole-2-carbaldehyde |
InChI Key | ZGTFNNUASMWGTM-UHFFFAOYSA-N |
Molecular Formula | C4H3NOS |
Fumaraldehyde Mono(dimethyl Acetal) (stabilized with HQ) 95.0+%, TCI America™
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CAS: 4093-49-6 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00191439 InChI Key: OJFHAFJGQZSFKT-ONEGZZNKSA-N Synonym: 4,4-Dimethoxy-2-butenal, 4,4-Dimethoxycrotonaldehyde PubChem CID: 10725377 IUPAC Name: (E)-4,4-dimethoxybut-2-enal SMILES: COC(C=CC=O)OC
PubChem CID | 10725377 |
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CAS | 4093-49-6 |
Molecular Weight (g/mol) | 130.143 |
MDL Number | MFCD00191439 |
SMILES | COC(C=CC=O)OC |
Synonym | 4,4-Dimethoxy-2-butenal, 4,4-Dimethoxycrotonaldehyde |
IUPAC Name | (E)-4,4-dimethoxybut-2-enal |
InChI Key | OJFHAFJGQZSFKT-ONEGZZNKSA-N |
Molecular Formula | C6H10O3 |
Ethyl 2-Formylpropionate 97.0+%, TCI America™
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CAS: 27772-62-9 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00044012 InChI Key: VVCYNVCCODBCOE-UHFFFAOYSA-N Synonym: 2-Formylpropionic Acid Ethyl Ester PubChem CID: 10898741 IUPAC Name: ethyl 2-methyl-3-oxopropanoate SMILES: CCOC(=O)C(C)C=O
PubChem CID | 10898741 |
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CAS | 27772-62-9 |
Molecular Weight (g/mol) | 130.143 |
MDL Number | MFCD00044012 |
SMILES | CCOC(=O)C(C)C=O |
Synonym | 2-Formylpropionic Acid Ethyl Ester |
IUPAC Name | ethyl 2-methyl-3-oxopropanoate |
InChI Key | VVCYNVCCODBCOE-UHFFFAOYSA-N |
Molecular Formula | C6H10O3 |
Methyl (4-Fluorobenzoyl)acetate 98.0+%, TCI America™
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CAS: 63131-29-3 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00000355 InChI Key: HGLVYXXPRSNKQN-UHFFFAOYSA-N Synonym: methyl 4-fluorobenzoylacetate,methyl 3-4-fluorophenyl-3-oxopropanoate,methyl p-fluorobenzoylacetate,4-fluorobenzoylacetic acid methyl ester,methyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester,benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester,benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester,pubchem16721,acmc-209nd6 PubChem CID: 579425 IUPAC Name: methyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)F
PubChem CID | 579425 |
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CAS | 63131-29-3 |
Molecular Weight (g/mol) | 196.177 |
MDL Number | MFCD00000355 |
SMILES | COC(=O)CC(=O)C1=CC=C(C=C1)F |
Synonym | methyl 4-fluorobenzoylacetate,methyl 3-4-fluorophenyl-3-oxopropanoate,methyl p-fluorobenzoylacetate,4-fluorobenzoylacetic acid methyl ester,methyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester,benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester,benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester,pubchem16721,acmc-209nd6 |
IUPAC Name | methyl 3-(4-fluorophenyl)-3-oxopropanoate |
InChI Key | HGLVYXXPRSNKQN-UHFFFAOYSA-N |
Molecular Formula | C10H9FO3 |
Ethyl (4-Fluorobenzoyl)acetate 98.0+%, TCI America™
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CAS: 1999-00-4 Molecular Formula: C11H11FO3 Molecular Weight (g/mol): 210.204 MDL Number: MFCD03093631 InChI Key: SJUXLKYJKQBZLM-UHFFFAOYSA-N Synonym: ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester PubChem CID: 2758844 IUPAC Name: ethyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)F
PubChem CID | 2758844 |
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CAS | 1999-00-4 |
Molecular Weight (g/mol) | 210.204 |
MDL Number | MFCD03093631 |
SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)F |
Synonym | ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester |
IUPAC Name | ethyl 3-(4-fluorophenyl)-3-oxopropanoate |
InChI Key | SJUXLKYJKQBZLM-UHFFFAOYSA-N |
Molecular Formula | C11H11FO3 |
5-Fluorosalicylaldehyde 98.0+%, TCI America™
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CAS: 347-54-6 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD01090997 InChI Key: FDUBQNUDZOGOFE-UHFFFAOYSA-N Synonym: 5-fluorosalicylaldehyde,5-fluoro-2-hydroxy-benzaldehyde,benzaldehyde, 5-fluoro-2-hydroxy,5-fluoro-2-hydroxy benzaldehyde,pubchem1444,5-fluoro salicylaldehyde,5-?fluorosalicylaldehyde,acmc-209ia4,ksc492m4t,pharmabridge p-2996 PubChem CID: 2737328 IUPAC Name: 5-fluoro-2-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1F)C=O)O
PubChem CID | 2737328 |
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CAS | 347-54-6 |
Molecular Weight (g/mol) | 140.113 |
MDL Number | MFCD01090997 |
SMILES | C1=CC(=C(C=C1F)C=O)O |
Synonym | 5-fluorosalicylaldehyde,5-fluoro-2-hydroxy-benzaldehyde,benzaldehyde, 5-fluoro-2-hydroxy,5-fluoro-2-hydroxy benzaldehyde,pubchem1444,5-fluoro salicylaldehyde,5-?fluorosalicylaldehyde,acmc-209ia4,ksc492m4t,pharmabridge p-2996 |
IUPAC Name | 5-fluoro-2-hydroxybenzaldehyde |
InChI Key | FDUBQNUDZOGOFE-UHFFFAOYSA-N |
Molecular Formula | C7H5FO2 |
5-Fluoroisatin 98.0+%, TCI America™
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CAS: 443-69-6 Molecular Formula: C8H4FNO2 Molecular Weight (g/mol): 165.123 MDL Number: MFCD00022795 InChI Key: GKODDAXOSGGARJ-UHFFFAOYSA-N Synonym: 5-fluoroisatin,5-fluoroindoline-2,3-dione,5-fluoro isatin,5-fluoro-2,3-dihydro-1h-indole-2,3-dione,5-fluoroisatine,5-fluoro-2,3-indoledione,5-fluoroindole-2,3-dione,1h-indole-2,3-dione, 5-fluoro,5-fluoro-2,3-indolinedione,5-fluoro-2,3-indolindione PubChem CID: 236566 IUPAC Name: 5-fluoro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1F)C(=O)C(=O)N2
PubChem CID | 236566 |
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CAS | 443-69-6 |
Molecular Weight (g/mol) | 165.123 |
MDL Number | MFCD00022795 |
SMILES | C1=CC2=C(C=C1F)C(=O)C(=O)N2 |
Synonym | 5-fluoroisatin,5-fluoroindoline-2,3-dione,5-fluoro isatin,5-fluoro-2,3-dihydro-1h-indole-2,3-dione,5-fluoroisatine,5-fluoro-2,3-indoledione,5-fluoroindole-2,3-dione,1h-indole-2,3-dione, 5-fluoro,5-fluoro-2,3-indolinedione,5-fluoro-2,3-indolindione |
IUPAC Name | 5-fluoro-1H-indole-2,3-dione |
InChI Key | GKODDAXOSGGARJ-UHFFFAOYSA-N |
Molecular Formula | C8H4FNO2 |
7-Fluoroisatin 98.0+%, TCI America™
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CAS: 317-20-4 Molecular Formula: C8H4FNO2 Molecular Weight (g/mol): 165.123 InChI Key: HGBGVEOXPHGSOS-UHFFFAOYSA-N Synonym: 7-fluoroisatin,7-fluoroindoline-2,3-dione,7-fluoro-2,3-indolinedione,1h-indole-2,3-dione, 7-fluoro,7-fluoroindole-1h-2,3-dione,7-fluoroindole-2,3-dione,7-fluoro-2,3-dihydro-1h-indole-2,3-dione,7-fluoroisatine,7-fluoro-1h-benzo d azoline-2,3-dione,7-fluor-1h-indol-2,3-dion PubChem CID: 586418 IUPAC Name: 7-fluoro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)F)NC(=O)C2=O
PubChem CID | 586418 |
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CAS | 317-20-4 |
Molecular Weight (g/mol) | 165.123 |
SMILES | C1=CC2=C(C(=C1)F)NC(=O)C2=O |
Synonym | 7-fluoroisatin,7-fluoroindoline-2,3-dione,7-fluoro-2,3-indolinedione,1h-indole-2,3-dione, 7-fluoro,7-fluoroindole-1h-2,3-dione,7-fluoroindole-2,3-dione,7-fluoro-2,3-dihydro-1h-indole-2,3-dione,7-fluoroisatine,7-fluoro-1h-benzo d azoline-2,3-dione,7-fluor-1h-indol-2,3-dion |
IUPAC Name | 7-fluoro-1H-indole-2,3-dione |
InChI Key | HGBGVEOXPHGSOS-UHFFFAOYSA-N |
Molecular Formula | C8H4FNO2 |
3-Fluorosalicylaldehyde 98.0+%, TCI America™
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CAS: 394-50-3 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.11 MDL Number: MFCD00003319 InChI Key: NWDHTEIVMDYWQJ-UHFFFAOYSA-N Synonym: 3-fluorosalicylaldehyde,3-fluoro-2-hydroxy-benzaldehyde,benzaldehyde, 3-fluoro-2-hydroxy,zlchem 257,pubchem4215,3-fluor-salicylaldehyd,acmc-209j5k,ksc497m8b,2-hydroxy-3-fluoro-benzaldehyde PubChem CID: 587788 IUPAC Name: 3-fluoro-2-hydroxybenzaldehyde SMILES: OC1=C(C=O)C=CC=C1F
PubChem CID | 587788 |
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CAS | 394-50-3 |
Molecular Weight (g/mol) | 140.11 |
MDL Number | MFCD00003319 |
SMILES | OC1=C(C=O)C=CC=C1F |
Synonym | 3-fluorosalicylaldehyde,3-fluoro-2-hydroxy-benzaldehyde,benzaldehyde, 3-fluoro-2-hydroxy,zlchem 257,pubchem4215,3-fluor-salicylaldehyd,acmc-209j5k,ksc497m8b,2-hydroxy-3-fluoro-benzaldehyde |
IUPAC Name | 3-fluoro-2-hydroxybenzaldehyde |
InChI Key | NWDHTEIVMDYWQJ-UHFFFAOYSA-N |
Molecular Formula | C7H5FO2 |
6-Fluoro-1-indanone 98.0+%, TCI America™
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CAS: 1481-32-9 Molecular Formula: C9H7FO Molecular Weight (g/mol): 150.15 MDL Number: MFCD01318147 InChI Key: LVUUCFIQQHEFEJ-UHFFFAOYSA-N Synonym: 6-fluoro-1-indanone,6-fluoro-2,3-dihydro-1h-inden-1-one,6-fluoro-indan-1-one,6-fluoroindan-1-one,6-fluroro-1-indanone,1h-inden-1-one, 6-fluoro-2,3-dihydro,6-fluoroindanone,6fluoro-1-indanone,pubchem8856,acmc-1bwfy PubChem CID: 1519464 IUPAC Name: 6-fluoro-2,3-dihydro-1H-inden-1-one SMILES: FC1=CC2=C(CCC2=O)C=C1
PubChem CID | 1519464 |
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CAS | 1481-32-9 |
Molecular Weight (g/mol) | 150.15 |
MDL Number | MFCD01318147 |
SMILES | FC1=CC2=C(CCC2=O)C=C1 |
Synonym | 6-fluoro-1-indanone,6-fluoro-2,3-dihydro-1h-inden-1-one,6-fluoro-indan-1-one,6-fluoroindan-1-one,6-fluroro-1-indanone,1h-inden-1-one, 6-fluoro-2,3-dihydro,6-fluoroindanone,6fluoro-1-indanone,pubchem8856,acmc-1bwfy |
IUPAC Name | 6-fluoro-2,3-dihydro-1H-inden-1-one |
InChI Key | LVUUCFIQQHEFEJ-UHFFFAOYSA-N |
Molecular Formula | C9H7FO |