Alpha beta-unsaturated carbonyl compounds
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Filtered Search Results
Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)gadolinium(III)
CAS: 14768-15-1 Molecular Formula: C33H57GdO6 Molecular Weight (g/mol): 707.06 MDL Number: MFCD00010349 InChI Key: UIVVGOMXFUOLAN-UHFFFAOYSA-N Synonym: tris 2,2,6,6-tetramethyl-3,5-heptanedionate gadolinium PubChem CID: 132984032 IUPAC Name: gadolinium;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: [Gd+3].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C
| PubChem CID | 132984032 |
|---|---|
| CAS | 14768-15-1 |
| Molecular Weight (g/mol) | 707.06 |
| MDL Number | MFCD00010349 |
| SMILES | [Gd+3].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C |
| Synonym | tris 2,2,6,6-tetramethyl-3,5-heptanedionate gadolinium |
| IUPAC Name | gadolinium;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one |
| InChI Key | UIVVGOMXFUOLAN-UHFFFAOYSA-N |
| Molecular Formula | C33H57GdO6 |
Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)nickel(II), 98%
CAS: 14481-08-4 Molecular Formula: C22H38NiO4 Molecular Weight (g/mol): 425.24 MDL Number: MFCD00192348 InChI Key: FPQQRRXEOLXSCJ-UHFFFAOYSA-N Synonym: bis 2,2,6,6-tetramethyl-3,5-heptanedionate nickel ii,bis 2,2,6,6-tetramethyl-3,5-heptanedionato nickel ii , min-ni ni tmhd 2 PubChem CID: 131675868 IUPAC Name: (E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;nickel SMILES: [Ni++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C
| PubChem CID | 131675868 |
|---|---|
| CAS | 14481-08-4 |
| Molecular Weight (g/mol) | 425.24 |
| MDL Number | MFCD00192348 |
| SMILES | [Ni++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C |
| Synonym | bis 2,2,6,6-tetramethyl-3,5-heptanedionate nickel ii,bis 2,2,6,6-tetramethyl-3,5-heptanedionato nickel ii , min-ni ni tmhd 2 |
| IUPAC Name | (E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;nickel |
| InChI Key | FPQQRRXEOLXSCJ-UHFFFAOYSA-N |
| Molecular Formula | C22H38NiO4 |
Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)cobalt(II), 99.9% (metals basis)
CAS: 13986-53-3 Molecular Formula: C22H38CoO4 Molecular Weight (g/mol): 425.48 MDL Number: MFCD00233616 InChI Key: KLJJOSZRALJWDS-UHFFFAOYSA-N Synonym: bis 2,2,6,6-tetramethyl-3,5-heptanedionato cobalt ii,cobalt 2+ bis 2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate PubChem CID: 57369563 IUPAC Name: cobalt(2+);2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate SMILES: [Co++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C
| PubChem CID | 57369563 |
|---|---|
| CAS | 13986-53-3 |
| Molecular Weight (g/mol) | 425.48 |
| MDL Number | MFCD00233616 |
| SMILES | [Co++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C |
| Synonym | bis 2,2,6,6-tetramethyl-3,5-heptanedionato cobalt ii,cobalt 2+ bis 2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate |
| IUPAC Name | cobalt(2+);2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate |
| InChI Key | KLJJOSZRALJWDS-UHFFFAOYSA-N |
| Molecular Formula | C22H38CoO4 |
2,5-Dimethyl-3-hexyne-2,5-diol, (+/-) + meso, 98%
CAS: 142-30-3 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00004468 InChI Key: IHJUECRFYCQBMW-UHFFFAOYSA-N Synonym: 2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol PubChem CID: 8883 IUPAC Name: 2,5-dimethylhex-3-yne-2,5-diol SMILES: CC(C)(C#CC(C)(C)O)O
| PubChem CID | 8883 |
|---|---|
| CAS | 142-30-3 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00004468 |
| SMILES | CC(C)(C#CC(C)(C)O)O |
| Synonym | 2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol |
| IUPAC Name | 2,5-dimethylhex-3-yne-2,5-diol |
| InChI Key | IHJUECRFYCQBMW-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Mesityl Oxide, Approx. 98%, Spectrum™ Chemical
CAS: 141-79-7 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.15 InChI Key: SHOJXDKTYKFBRD-UHFFFAOYSA-N IUPAC Name: 4-methylpent-3-en-2-one SMILES: CC(C)=CC(C)=O
| CAS | 141-79-7 |
|---|---|
| Molecular Weight (g/mol) | 98.15 |
| SMILES | CC(C)=CC(C)=O |
| IUPAC Name | 4-methylpent-3-en-2-one |
| InChI Key | SHOJXDKTYKFBRD-UHFFFAOYSA-N |
| Molecular Formula | C6H10O |
Tris(dibenzylideneacetone)dipalladium(0), Pd 21.5% min
CAS: 51364-51-3 Molecular Formula: C51H42O3Pd2 Molecular Weight (g/mol): 915.73 MDL Number: MFCD00013310 InChI Key: CYPYTURSJDMMMP-UHFFFAOYSA-N Synonym: tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium PubChem CID: 9811564 IUPAC Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium SMILES: [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1
| PubChem CID | 9811564 |
|---|---|
| CAS | 51364-51-3 |
| Molecular Weight (g/mol) | 915.73 |
| MDL Number | MFCD00013310 |
| SMILES | [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1 |
| Synonym | tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium |
| IUPAC Name | (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium |
| InChI Key | CYPYTURSJDMMMP-UHFFFAOYSA-N |
| Molecular Formula | C51H42O3Pd2 |
beta-Ionone, 96%
CAS: 79-77-6 Molecular Formula: C13H20O Molecular Weight (g/mol): 192.302 MDL Number: MFCD00001549 InChI Key: PSQYTAPXSHCGMF-BQYQJAHWSA-N Synonym: beta-ionone,trans-beta-ionone,e-beta-ionone,4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,.beta.-ionone,3e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,4-2,6,6-trimethyl-1-cyclohexenyl-3-buten-2-one,unii-a7nrr1hlh6,e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,beta-e-ionone PubChem CID: 638014 ChEBI: CHEBI:32325 IUPAC Name: (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one SMILES: CC1=C(C(CCC1)(C)C)C=CC(=O)C
| PubChem CID | 638014 |
|---|---|
| CAS | 79-77-6 |
| Molecular Weight (g/mol) | 192.302 |
| ChEBI | CHEBI:32325 |
| MDL Number | MFCD00001549 |
| SMILES | CC1=C(C(CCC1)(C)C)C=CC(=O)C |
| Synonym | beta-ionone,trans-beta-ionone,e-beta-ionone,4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,.beta.-ionone,3e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,4-2,6,6-trimethyl-1-cyclohexenyl-3-buten-2-one,unii-a7nrr1hlh6,e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,beta-e-ionone |
| IUPAC Name | (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one |
| InChI Key | PSQYTAPXSHCGMF-BQYQJAHWSA-N |
| Molecular Formula | C13H20O |
3-Hexyn-2-one, 97%
CAS: 1679-36-3 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.129 MDL Number: MFCD00041627 InChI Key: LTAPKZGQTMVYMX-UHFFFAOYSA-N Synonym: 3-hexyn-2-one,2-oxo-3-hexyne,acmc-209dxd,1-butynyl methyl ketone PubChem CID: 137151 IUPAC Name: hex-3-yn-2-one SMILES: CCC#CC(=O)C
| PubChem CID | 137151 |
|---|---|
| CAS | 1679-36-3 |
| Molecular Weight (g/mol) | 96.129 |
| MDL Number | MFCD00041627 |
| SMILES | CCC#CC(=O)C |
| Synonym | 3-hexyn-2-one,2-oxo-3-hexyne,acmc-209dxd,1-butynyl methyl ketone |
| IUPAC Name | hex-3-yn-2-one |
| InChI Key | LTAPKZGQTMVYMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8O |
Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)barium(II) hydrate, 98+%, Thermo Scientific™
CAS: 17594-47-7 Molecular Formula: C22H38BaO4 Molecular Weight (g/mol): 503.87 MDL Number: MFCD00058709 InChI Key: VJRLFEOHKCDHBT-UHFFFAOYSA-N Synonym: barium-dpm,ba tmhd 2,bis 2,2,6,6-tetramethyl-3,5-heptanedionato barium ii,barium 2,2,6,6-tetramethyl-3,5-heptanedionate tetramer,barium bis 2,2,6,6-tetramethyl-3,5-heptanedionate hydrate,bis 2,2,6,6-tetramethyl-3,5-heptanedionate barium ii,barium-thd,barium bis dipivaloylmethanate,barium ii 2,2,6,6-tetramethylheptanedionate,bis 2,2,6,6-tetramethyl-3,5 heptanedionato barium ii PubChem CID: 17749137 IUPAC Name: barium(2+);(Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate;hydrate SMILES: [Ba++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C
| PubChem CID | 17749137 |
|---|---|
| CAS | 17594-47-7 |
| Molecular Weight (g/mol) | 503.87 |
| MDL Number | MFCD00058709 |
| SMILES | [Ba++].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C |
| Synonym | barium-dpm,ba tmhd 2,bis 2,2,6,6-tetramethyl-3,5-heptanedionato barium ii,barium 2,2,6,6-tetramethyl-3,5-heptanedionate tetramer,barium bis 2,2,6,6-tetramethyl-3,5-heptanedionate hydrate,bis 2,2,6,6-tetramethyl-3,5-heptanedionate barium ii,barium-thd,barium bis dipivaloylmethanate,barium ii 2,2,6,6-tetramethylheptanedionate,bis 2,2,6,6-tetramethyl-3,5 heptanedionato barium ii |
| IUPAC Name | barium(2+);(Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate;hydrate |
| InChI Key | VJRLFEOHKCDHBT-UHFFFAOYSA-N |
| Molecular Formula | C22H38BaO4 |
3,5-Dimethyl-1-hexyn-3-ol 98.0+%, TCI America™
CAS: 107-54-0 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.20 MDL Number: MFCD00008941 InChI Key: NECRQCBKTGZNMH-UHFFFAOYNA-N Synonym: 3,5-dimethyl-1-hexyn-3-ol,surfynol,surfynol 61,1-hexyn-3-ol, 3,5-dimethyl,surfynol van,sialyl-3-paragloboside,acmc-2098wy,dsstox_cid_21472,dsstox_rid_79746,dsstox_gsid_41472 PubChem CID: 61018 IUPAC Name: 3,5-dimethylhex-1-yn-3-ol SMILES: CC(C)CC(C)(O)C#C
| PubChem CID | 61018 |
|---|---|
| CAS | 107-54-0 |
| Molecular Weight (g/mol) | 126.20 |
| MDL Number | MFCD00008941 |
| SMILES | CC(C)CC(C)(O)C#C |
| Synonym | 3,5-dimethyl-1-hexyn-3-ol,surfynol,surfynol 61,1-hexyn-3-ol, 3,5-dimethyl,surfynol van,sialyl-3-paragloboside,acmc-2098wy,dsstox_cid_21472,dsstox_rid_79746,dsstox_gsid_41472 |
| IUPAC Name | 3,5-dimethylhex-1-yn-3-ol |
| InChI Key | NECRQCBKTGZNMH-UHFFFAOYNA-N |
| Molecular Formula | C8H14O |
3-Dimethylamino-2-methyl-2-propenal 97.0+%, TCI America™
CAS: 19125-76-9 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00075471 InChI Key: JGAMOQYFDMQPRJ-XQRVVYSFSA-N Synonym: z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylprop-2-enal,z-3-dimethylamino-2-methylprop-2-enal,2-propenal, 3-dimethylamino-2-methyl-, z,2-propenal, 3-dimethylamino-2-methyl-, 2z PubChem CID: 5919306 IUPAC Name: (Z)-3-(dimethylamino)-2-methylprop-2-enal SMILES: CC(=CN(C)C)C=O
| PubChem CID | 5919306 |
|---|---|
| CAS | 19125-76-9 |
| Molecular Weight (g/mol) | 113.16 |
| MDL Number | MFCD00075471 |
| SMILES | CC(=CN(C)C)C=O |
| Synonym | z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylprop-2-enal,z-3-dimethylamino-2-methylprop-2-enal,2-propenal, 3-dimethylamino-2-methyl-, z,2-propenal, 3-dimethylamino-2-methyl-, 2z |
| IUPAC Name | (Z)-3-(dimethylamino)-2-methylprop-2-enal |
| InChI Key | JGAMOQYFDMQPRJ-XQRVVYSFSA-N |
| Molecular Formula | C6H11NO |
Tris(hexafluoroacetylacetonato)iron(III) 95.0+%, TCI America™
CAS: 17786-67-3 Molecular Formula: C15H3F18FeO6 Molecular Weight (g/mol): 676.999 MDL Number: MFCD00059457 InChI Key: NBPRJLXRDBDIFS-VRBCMZOBSA-K Synonym: Ferric(III) Hexafluoroacetylacetonate, Hexafluoroacetylacetono Iron(III) Salt, Iron(III) Hexafluoroacetylacetonate PubChem CID: 53384549 IUPAC Name: (E)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;iron(3+) SMILES: C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Fe+3]
| PubChem CID | 53384549 |
|---|---|
| CAS | 17786-67-3 |
| Molecular Weight (g/mol) | 676.999 |
| MDL Number | MFCD00059457 |
| SMILES | C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Fe+3] |
| Synonym | Ferric(III) Hexafluoroacetylacetonate, Hexafluoroacetylacetono Iron(III) Salt, Iron(III) Hexafluoroacetylacetonate |
| IUPAC Name | (E)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;iron(3+) |
| InChI Key | NBPRJLXRDBDIFS-VRBCMZOBSA-K |
| Molecular Formula | C15H3F18FeO6 |
Tris(2,4-pentanedionato)ruthenium(III), TCI America™
CAS: 14284-93-6 Molecular Formula: C15H21O6Ru Molecular Weight (g/mol): 398.40 MDL Number: MFCD00000030 InChI Key: RTZYCRSRNSTRGC-LNTINUHCSA-K Synonym: ruthenium acetylacetonate,ruthenium iii acetylacetonate,acetylacetone ruthenium iii salt,tris 2,4-pentanedionato ruthenium iii,tris pentane-2,4-dionato-o,o' ruthenium,ruthenium, tris 2,4-pentanedionato-o,o'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-kappao,kappao'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-8ci,z-4-oxopent-2-en-2-olate; ruthenium 3+ PubChem CID: 5488829 IUPAC Name: ruthenium(3+) tris((2Z)-4-oxopent-2-en-2-olate) SMILES: [Ru+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
| PubChem CID | 5488829 |
|---|---|
| CAS | 14284-93-6 |
| Molecular Weight (g/mol) | 398.40 |
| MDL Number | MFCD00000030 |
| SMILES | [Ru+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
| Synonym | ruthenium acetylacetonate,ruthenium iii acetylacetonate,acetylacetone ruthenium iii salt,tris 2,4-pentanedionato ruthenium iii,tris pentane-2,4-dionato-o,o' ruthenium,ruthenium, tris 2,4-pentanedionato-o,o'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-kappao,kappao'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-8ci,z-4-oxopent-2-en-2-olate; ruthenium 3+ |
| IUPAC Name | ruthenium(3+) tris((2Z)-4-oxopent-2-en-2-olate) |
| InChI Key | RTZYCRSRNSTRGC-LNTINUHCSA-K |
| Molecular Formula | C15H21O6Ru |
Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)europium(III) 95.0+%, TCI America™
CAS: 15522-71-1 Molecular Formula: C33H60EuO6 Molecular Weight (g/mol): 704.801 MDL Number: MFCD00000019 InChI Key: RHXUZKJNHAMZEP-QFVJJVGWSA-N Synonym: eu dpm 3,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium iii,resolve-al tm,europium iii-dpm,eu tmhd 3,europium 2,2,6,6-tetramethyl-3,5-heptanedionate,europium-tris dipivaloylmethane,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium 3 PubChem CID: 10897800 IUPAC Name: europium;(E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Eu]
| PubChem CID | 10897800 |
|---|---|
| CAS | 15522-71-1 |
| Molecular Weight (g/mol) | 704.801 |
| MDL Number | MFCD00000019 |
| SMILES | CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Eu] |
| Synonym | eu dpm 3,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium iii,resolve-al tm,europium iii-dpm,eu tmhd 3,europium 2,2,6,6-tetramethyl-3,5-heptanedionate,europium-tris dipivaloylmethane,tris 2,2,6,6-tetramethyl-3,5-heptanedionato europium 3 |
| IUPAC Name | europium;(E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one |
| InChI Key | RHXUZKJNHAMZEP-QFVJJVGWSA-N |
| Molecular Formula | C33H60EuO6 |
Efavirenz 98.0+%, TCI America™
CAS: 154598-52-4 Molecular Formula: C14H9ClF3NO2 Molecular Weight (g/mol): 315.676 MDL Number: MFCD05662344 InChI Key: XPOQHMRABVBWPR-ZDUSSCGKSA-N Synonym: (4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one PubChem CID: 64139 ChEBI: CHEBI:119486 IUPAC Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one SMILES: C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
| PubChem CID | 64139 |
|---|---|
| CAS | 154598-52-4 |
| Molecular Weight (g/mol) | 315.676 |
| ChEBI | CHEBI:119486 |
| MDL Number | MFCD05662344 |
| SMILES | C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F |
| Synonym | (4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one |
| IUPAC Name | (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one |
| InChI Key | XPOQHMRABVBWPR-ZDUSSCGKSA-N |
| Molecular Formula | C14H9ClF3NO2 |