Organooxygen compounds
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Tetrakis(2,4-pentanedionato)zirconium(IV), TCI America™
CAS: 17501-44-9 Molecular Formula: C20H28O8Zr Molecular Weight (g/mol): 487.66 MDL Number: MFCD00000036 InChI Key: DFPGFWYWSAYLCW-UHFFFAOYSA-N Synonym: 4-hydroxypent-3-en-2-one; zirconium PubChem CID: 50912253 IUPAC Name: zirconium(4+) tetrakis(2,4-dioxopentan-3-ide) SMILES: [Zr+4].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O
| PubChem CID | 50912253 |
|---|---|
| CAS | 17501-44-9 |
| Molecular Weight (g/mol) | 487.66 |
| MDL Number | MFCD00000036 |
| SMILES | [Zr+4].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O |
| Synonym | 4-hydroxypent-3-en-2-one; zirconium |
| IUPAC Name | zirconium(4+) tetrakis(2,4-dioxopentan-3-ide) |
| InChI Key | DFPGFWYWSAYLCW-UHFFFAOYSA-N |
| Molecular Formula | C20H28O8Zr |
3-Methyl-1-penten-4-yn-3-ol 98.0+%, TCI America™
CAS: 3230-69-1 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.13 MDL Number: MFCD01709006 InChI Key: VBATUBQIYXCZPA-UHFFFAOYNA-N Synonym: 3-methyl-1-penten-4-yn-3-ol,1-penten-4-yn-3-ol, 3-methyl,ethynyl methyl vinyl carbinol,3-methyl-pent-4-en-1-yn-3-ol,3-methyl pent-4-en-l-yn-3-0l,acmc-209hsd,4-01-00-02309 beilstein handbook reference,ksc496k7h,wln: 1uu1xq1&1u1,3-methyl-4-penten-1-yn-3-ol PubChem CID: 97815 IUPAC Name: 3-methylpent-1-en-4-yn-3-ol SMILES: CC(O)(C=C)C#C
| PubChem CID | 97815 |
|---|---|
| CAS | 3230-69-1 |
| Molecular Weight (g/mol) | 96.13 |
| MDL Number | MFCD01709006 |
| SMILES | CC(O)(C=C)C#C |
| Synonym | 3-methyl-1-penten-4-yn-3-ol,1-penten-4-yn-3-ol, 3-methyl,ethynyl methyl vinyl carbinol,3-methyl-pent-4-en-1-yn-3-ol,3-methyl pent-4-en-l-yn-3-0l,acmc-209hsd,4-01-00-02309 beilstein handbook reference,ksc496k7h,wln: 1uu1xq1&1u1,3-methyl-4-penten-1-yn-3-ol |
| IUPAC Name | 3-methylpent-1-en-4-yn-3-ol |
| InChI Key | VBATUBQIYXCZPA-UHFFFAOYNA-N |
| Molecular Formula | C6H8O |
Bis(trifluoro-2,4-pentanedionato)cobalt(II) Hydrate 90.0+%, TCI America™
CAS: 16092-38-9 Molecular Formula: C10H10CoF6O4 Molecular Weight (g/mol): 367.11 MDL Number: MFCD00044994 InChI Key: GCHODJIKBYKCNY-UHFFFAOYSA-N Synonym: Cobalt(II) Trifluoroacetylacetonate, Trifluoroacetylacetono Cobalt(II) Salt PubChem CID: 102601710 IUPAC Name: bis(5,5,5-trifluoro-4-hydroxypent-3-en-2-one) cobalt SMILES: [Co].CC(=O)C=C(O)C(F)(F)F.CC(=O)C=C(O)C(F)(F)F
| PubChem CID | 102601710 |
|---|---|
| CAS | 16092-38-9 |
| Molecular Weight (g/mol) | 367.11 |
| MDL Number | MFCD00044994 |
| SMILES | [Co].CC(=O)C=C(O)C(F)(F)F.CC(=O)C=C(O)C(F)(F)F |
| Synonym | Cobalt(II) Trifluoroacetylacetonate, Trifluoroacetylacetono Cobalt(II) Salt |
| IUPAC Name | bis(5,5,5-trifluoro-4-hydroxypent-3-en-2-one) cobalt |
| InChI Key | GCHODJIKBYKCNY-UHFFFAOYSA-N |
| Molecular Formula | C10H10CoF6O4 |
3-Butyn-2-one 97.0+%, TCI America™
CAS: 1423-60-5 Molecular Formula: C4H4O Molecular Weight (g/mol): 68.08 MDL Number: MFCD00008775 InChI Key: XRGPFNGLRSIPSA-UHFFFAOYSA-N Synonym: 3-butyn-2-one,1-butyn-3-one,methyl ethynyl ketone,acetylacetylene,butyn-2-one,acetylethyne,1-butyne-3-one,3-butyne-2-one,ethynyl methyl ketone,ch3coc#ch PubChem CID: 15018 ChEBI: CHEBI:48060 IUPAC Name: but-3-yn-2-one SMILES: CC(=O)C#C
| PubChem CID | 15018 |
|---|---|
| CAS | 1423-60-5 |
| Molecular Weight (g/mol) | 68.08 |
| ChEBI | CHEBI:48060 |
| MDL Number | MFCD00008775 |
| SMILES | CC(=O)C#C |
| Synonym | 3-butyn-2-one,1-butyn-3-one,methyl ethynyl ketone,acetylacetylene,butyn-2-one,acetylethyne,1-butyne-3-one,3-butyne-2-one,ethynyl methyl ketone,ch3coc#ch |
| IUPAC Name | but-3-yn-2-one |
| InChI Key | XRGPFNGLRSIPSA-UHFFFAOYSA-N |
| Molecular Formula | C4H4O |
3,4-Dimethyl-1-pentyn-3-ol 96.0+%, TCI America™
CAS: 1482-15-1 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.17 MDL Number: MFCD00039845 InChI Key: DZNLEQBXXLGELU-UHFFFAOYNA-N Synonym: 3,4-dimethyl-1-pentyn-3-ol,1-pentyn-3-ol, 3,4-dimethyl,acmc-1bzc3,2-isopropyl-3-butyne-2-ol,1-pentyn-3-ol,4-dimethyl,3,4-dimethyl-pent-1-yn-3-ol,dznleqbxxlgelu-uhfffaoysa,1-pentyn-3-ol,3,4-dimethyl,1,2-dimethyl-1-hydroxypropyl acetylene PubChem CID: 95483 IUPAC Name: 3,4-dimethylpent-1-yn-3-ol SMILES: CC(C)C(C)(O)C#C
| PubChem CID | 95483 |
|---|---|
| CAS | 1482-15-1 |
| Molecular Weight (g/mol) | 112.17 |
| MDL Number | MFCD00039845 |
| SMILES | CC(C)C(C)(O)C#C |
| Synonym | 3,4-dimethyl-1-pentyn-3-ol,1-pentyn-3-ol, 3,4-dimethyl,acmc-1bzc3,2-isopropyl-3-butyne-2-ol,1-pentyn-3-ol,4-dimethyl,3,4-dimethyl-pent-1-yn-3-ol,dznleqbxxlgelu-uhfffaoysa,1-pentyn-3-ol,3,4-dimethyl,1,2-dimethyl-1-hydroxypropyl acetylene |
| IUPAC Name | 3,4-dimethylpent-1-yn-3-ol |
| InChI Key | DZNLEQBXXLGELU-UHFFFAOYNA-N |
| Molecular Formula | C7H12O |
Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)praseodymium(III) 98.0+%, TCI America™
CAS: 15492-48-5 Molecular Formula: C33H57O6Pr Molecular Weight (g/mol): 690.72 MDL Number: MFCD00000027,MFCD00000027 InChI Key: HDONDLBRVFKILD-UHFFFAOYSA-K Synonym: pr dpm 3,praseodymium iii tris 2,2,6,6-tetramethyl-3,5-heptanedionate PubChem CID: 53384607 IUPAC Name: praseodymium(3+) tris(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) SMILES: [Pr+3].CC(C)(C)C([O-])=CC(=O)C(C)(C)C.CC(C)(C)C([O-])=CC(=O)C(C)(C)C.CC(C)(C)C([O-])=CC(=O)C(C)(C)C
| PubChem CID | 53384607 |
|---|---|
| CAS | 15492-48-5 |
| Molecular Weight (g/mol) | 690.72 |
| MDL Number | MFCD00000027,MFCD00000027 |
| SMILES | [Pr+3].CC(C)(C)C([O-])=CC(=O)C(C)(C)C.CC(C)(C)C([O-])=CC(=O)C(C)(C)C.CC(C)(C)C([O-])=CC(=O)C(C)(C)C |
| Synonym | pr dpm 3,praseodymium iii tris 2,2,6,6-tetramethyl-3,5-heptanedionate |
| IUPAC Name | praseodymium(3+) tris(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) |
| InChI Key | HDONDLBRVFKILD-UHFFFAOYSA-K |
| Molecular Formula | C33H57O6Pr |
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-Nonen-2-one 96.0+%, TCI America™
CAS: 14309-57-0 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.23 MDL Number: MFCD00010241 InChI Key: HDKLIZDXVUCLHQ-BQYQJAHWSA-N Synonym: 3-nonen-2-one,trans-3-nonen-2-one,e-non-3-en-2-one,e-3-nonen-2-one,3-nonen-2-one, 3e,3e-3-nonen-2-one,3e-non-3-en-2-one,unii-fr0k39of16,3e-nonen-2-one,3-nonen-2-one fhfi PubChem CID: 5317045 IUPAC Name: (3E)-non-3-en-2-one SMILES: CCCCC\C=C\C(C)=O
| PubChem CID | 5317045 |
|---|---|
| CAS | 14309-57-0 |
| Molecular Weight (g/mol) | 140.23 |
| MDL Number | MFCD00010241 |
| SMILES | CCCCC\C=C\C(C)=O |
| Synonym | 3-nonen-2-one,trans-3-nonen-2-one,e-non-3-en-2-one,e-3-nonen-2-one,3-nonen-2-one, 3e,3e-3-nonen-2-one,3e-non-3-en-2-one,unii-fr0k39of16,3e-nonen-2-one,3-nonen-2-one fhfi |
| IUPAC Name | (3E)-non-3-en-2-one |
| InChI Key | HDKLIZDXVUCLHQ-BQYQJAHWSA-N |
| Molecular Formula | C9H16O |
3-Methyl-3-penten-2-one 95.0+%, TCI America™
CAS: 565-62-8 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00151839 InChI Key: ZAMCMCQRTZKGDX-SNAWJCMRSA-N Synonym: 3-methyl-3-penten-2-one,e-3-methylpent-3-en-2-one,e-3-methyl-3-penten-2-one,unii-jbr4o01db2,jbr4o01db2,3-methyl-2-penten-4-one,3-penten-2-one, 3-methyl,3-methyl-3-pentene-2-one,2-acetyl-2-butene,3-methyl-4-oxopent-2-ene PubChem CID: 5364579 IUPAC Name: (E)-3-methylpent-3-en-2-one SMILES: CC=C(C)C(=O)C
| PubChem CID | 5364579 |
|---|---|
| CAS | 565-62-8 |
| Molecular Weight (g/mol) | 98.145 |
| MDL Number | MFCD00151839 |
| SMILES | CC=C(C)C(=O)C |
| Synonym | 3-methyl-3-penten-2-one,e-3-methylpent-3-en-2-one,e-3-methyl-3-penten-2-one,unii-jbr4o01db2,jbr4o01db2,3-methyl-2-penten-4-one,3-penten-2-one, 3-methyl,3-methyl-3-pentene-2-one,2-acetyl-2-butene,3-methyl-4-oxopent-2-ene |
| IUPAC Name | (E)-3-methylpent-3-en-2-one |
| InChI Key | ZAMCMCQRTZKGDX-SNAWJCMRSA-N |
| Molecular Formula | C6H10O |
2-Octen-4-one 96.0+%, TCI America™
CAS: 4643-27-0 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.199 MDL Number: MFCD00061023 InChI Key: FMDLEUPBHMCPQV-GQCTYLIASA-N Synonym: 2-octen-4-one,propenyl butyl ketone,butyl propenyl ketone,unii-c9nb51lmxt,2-octen-4-one natural,fema no. 3603,c9nb51lmxt,e-oct-2-en-4-one,2e-oct-2-en-4-one,2e-2-octen-4-one PubChem CID: 5365891 IUPAC Name: (E)-oct-2-en-4-one SMILES: CCCCC(=O)C=CC
| PubChem CID | 5365891 |
|---|---|
| CAS | 4643-27-0 |
| Molecular Weight (g/mol) | 126.199 |
| MDL Number | MFCD00061023 |
| SMILES | CCCCC(=O)C=CC |
| Synonym | 2-octen-4-one,propenyl butyl ketone,butyl propenyl ketone,unii-c9nb51lmxt,2-octen-4-one natural,fema no. 3603,c9nb51lmxt,e-oct-2-en-4-one,2e-oct-2-en-4-one,2e-2-octen-4-one |
| IUPAC Name | (E)-oct-2-en-4-one |
| InChI Key | FMDLEUPBHMCPQV-GQCTYLIASA-N |
| Molecular Formula | C8H14O |
Methyl 2-Oxocyclopentanecarboxylate 97.0+%, TCI America™
CAS: 10472-24-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00001411 InChI Key: PZBBESSUKAHBHD-UHFFFAOYSA-N Synonym: methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane PubChem CID: 66328 IUPAC Name: methyl 2-oxocyclopentane-1-carboxylate SMILES: COC(=O)C1CCCC1=O
| PubChem CID | 66328 |
|---|---|
| CAS | 10472-24-9 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD00001411 |
| SMILES | COC(=O)C1CCCC1=O |
| Synonym | methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane |
| IUPAC Name | methyl 2-oxocyclopentane-1-carboxylate |
| InChI Key | PZBBESSUKAHBHD-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |
N,N-Diethylacetoacetamide 98.0+%, TCI America™
CAS: 2235-46-3 Molecular Formula: C8H15NO2 Molecular Weight (g/mol): 157.213 MDL Number: MFCD00026728 InChI Key: NTMXFHGYWJIAAE-UHFFFAOYSA-N Synonym: n,n-diethylacetoacetamide,n,n-diethyl-3-oxobutyramide,diethylacetoacetamide,butanamide, n,n-diethyl-3-oxo,acetoacetamide, n,n-diethyl,1-diethylcarbamoyl-2-propanone,n,n-diethylacetylacetamide,acetoacetdiethylamide,diethylamid kyseliny acetoctove,diethylamid kyseliny acetoctove czech PubChem CID: 16699 IUPAC Name: N,N-diethyl-3-oxobutanamide SMILES: CCN(CC)C(=O)CC(=O)C
| PubChem CID | 16699 |
|---|---|
| CAS | 2235-46-3 |
| Molecular Weight (g/mol) | 157.213 |
| MDL Number | MFCD00026728 |
| SMILES | CCN(CC)C(=O)CC(=O)C |
| Synonym | n,n-diethylacetoacetamide,n,n-diethyl-3-oxobutyramide,diethylacetoacetamide,butanamide, n,n-diethyl-3-oxo,acetoacetamide, n,n-diethyl,1-diethylcarbamoyl-2-propanone,n,n-diethylacetylacetamide,acetoacetdiethylamide,diethylamid kyseliny acetoctove,diethylamid kyseliny acetoctove czech |
| IUPAC Name | N,N-diethyl-3-oxobutanamide |
| InChI Key | NTMXFHGYWJIAAE-UHFFFAOYSA-N |
| Molecular Formula | C8H15NO2 |
Dibenzyl Malonate 95.0+%, TCI America™
CAS: 15014-25-2 Molecular Formula: C17H16O4 Molecular Weight (g/mol): 284.311 MDL Number: MFCD00004779 InChI Key: RYFCSKVXWRJEOB-UHFFFAOYSA-N PubChem CID: 84754 IUPAC Name: dibenzyl propanedioate SMILES: C1=CC=C(C=C1)COC(=O)CC(=O)OCC2=CC=CC=C2
| PubChem CID | 84754 |
|---|---|
| CAS | 15014-25-2 |
| Molecular Weight (g/mol) | 284.311 |
| MDL Number | MFCD00004779 |
| SMILES | C1=CC=C(C=C1)COC(=O)CC(=O)OCC2=CC=CC=C2 |
| IUPAC Name | dibenzyl propanedioate |
| InChI Key | RYFCSKVXWRJEOB-UHFFFAOYSA-N |
| Molecular Formula | C17H16O4 |
2,6-Dimethyl-5-heptenal 85.0+%, TCI America™
CAS: 106-72-9 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00006981 InChI Key: YGFGZTXGYTUXBA-UHFFFAOYSA-N Synonym: 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural PubChem CID: 61016 IUPAC Name: 2,6-dimethylhept-5-enal SMILES: CC(CCC=C(C)C)C=O
| PubChem CID | 61016 |
|---|---|
| CAS | 106-72-9 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00006981 |
| SMILES | CC(CCC=C(C)C)C=O |
| Synonym | 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural |
| IUPAC Name | 2,6-dimethylhept-5-enal |
| InChI Key | YGFGZTXGYTUXBA-UHFFFAOYSA-N |
| Molecular Formula | C9H16O |
3-Methylthiophene-2-carboxaldehyde 85.0+%, TCI America™
CAS: 5834-16-2 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005430 InChI Key: BSQKBHXYEKVKMN-UHFFFAOYSA-N Synonym: 3-methyl-2-thiophenecarboxaldehyde,3-methylthiophene-2-carboxaldehyde,2-formyl-3-methylthiophene,3-methylthiophene-2-aldehyde,3-methyl-2-thiophenecarbaldehyde,3-methyl-2-formylthiophene,3-methyl-2-thiophene carboxaldehyde,2-thiophenecarboxaldehyde, 3-methyl,thiophenecarboxaldehyde, methyl,3-methyl-thiophene-2-carbaldehyde PubChem CID: 79911 IUPAC Name: 3-methylthiophene-2-carbaldehyde SMILES: CC1=C(SC=C1)C=O
| PubChem CID | 79911 |
|---|---|
| CAS | 5834-16-2 |
| Molecular Weight (g/mol) | 126.173 |
| MDL Number | MFCD00005430 |
| SMILES | CC1=C(SC=C1)C=O |
| Synonym | 3-methyl-2-thiophenecarboxaldehyde,3-methylthiophene-2-carboxaldehyde,2-formyl-3-methylthiophene,3-methylthiophene-2-aldehyde,3-methyl-2-thiophenecarbaldehyde,3-methyl-2-formylthiophene,3-methyl-2-thiophene carboxaldehyde,2-thiophenecarboxaldehyde, 3-methyl,thiophenecarboxaldehyde, methyl,3-methyl-thiophene-2-carbaldehyde |
| IUPAC Name | 3-methylthiophene-2-carbaldehyde |
| InChI Key | BSQKBHXYEKVKMN-UHFFFAOYSA-N |
| Molecular Formula | C6H6OS |