Organooxygen compounds
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Diethylene glycol dibutyl ether, 99+%, pure
CAS: 112-73-2 Molecular Formula: C12H26O3 Molecular Weight (g/mol): 218.34 InChI Key: KZVBBTZJMSWGTK-UHFFFAOYSA-N Synonym: diethylene glycol dibutyl ether,bis 2-butoxyethyl ether,dibutyl carbitol,butyl diglyme,1-2-2-butoxyethoxy ethoxy butane,5,8,11-trioxapentadecane,ether, bis butoxyethyl,2,2'-dibutoxyethyl ether,ether, bis 2-butoxyethyl PubChem CID: 8210 IUPAC Name: 1-[2-(2-butoxyethoxy)ethoxy]butane SMILES: CCCCOCCOCCOCCCC
| PubChem CID | 8210 |
|---|---|
| CAS | 112-73-2 |
| Molecular Weight (g/mol) | 218.34 |
| SMILES | CCCCOCCOCCOCCCC |
| Synonym | diethylene glycol dibutyl ether,bis 2-butoxyethyl ether,dibutyl carbitol,butyl diglyme,1-2-2-butoxyethoxy ethoxy butane,5,8,11-trioxapentadecane,ether, bis butoxyethyl,2,2'-dibutoxyethyl ether,ether, bis 2-butoxyethyl |
| IUPAC Name | 1-[2-(2-butoxyethoxy)ethoxy]butane |
| InChI Key | KZVBBTZJMSWGTK-UHFFFAOYSA-N |
| Molecular Formula | C12H26O3 |
4-Chloro-1-butanol, tech. 85%
CAS: 928-51-8 Molecular Formula: C4H9ClO Molecular Weight (g/mol): 108.57 MDL Number: MFCD00002967 InChI Key: HXHGULXINZUGJX-UHFFFAOYSA-N Synonym: 4-chloro-1-butanol,4-chlorobutanol,1-butanol, 4-chloro,tetramethylene chlorohydrin,4-chloro-1-butane-ol,4-chlorbutan-1-ol,unii-42ei3i5ay0,4-chlorbutan-1-ol german,ccris 7507,4-chloro-butan-1-ol PubChem CID: 13569 ChEBI: CHEBI:87310 IUPAC Name: 4-chlorobutan-1-ol SMILES: OCCCCCl
| PubChem CID | 13569 |
|---|---|
| CAS | 928-51-8 |
| Molecular Weight (g/mol) | 108.57 |
| ChEBI | CHEBI:87310 |
| MDL Number | MFCD00002967 |
| SMILES | OCCCCCl |
| Synonym | 4-chloro-1-butanol,4-chlorobutanol,1-butanol, 4-chloro,tetramethylene chlorohydrin,4-chloro-1-butane-ol,4-chlorbutan-1-ol,unii-42ei3i5ay0,4-chlorbutan-1-ol german,ccris 7507,4-chloro-butan-1-ol |
| IUPAC Name | 4-chlorobutan-1-ol |
| InChI Key | HXHGULXINZUGJX-UHFFFAOYSA-N |
| Molecular Formula | C4H9ClO |
Zirconium(IV) 2,4-pentanedionate, Thermo Scientific Chemicals
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: 4-hydroxypent-3-en-2-one;zirconium 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 | 4-hydroxypent-3-en-2-one;zirconium |
| InChI Key | DFPGFWYWSAYLCW-UHFFFAOYSA-N |
| Molecular Formula | C20H28O8Zr |
Tris(dibenzylideneacetone)dipalladium(0), 97%
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 |
Ethylene glycol diethyl ether, 99%
CAS: 629-14-1 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00009253 InChI Key: LZDKZFUFMNSQCJ-UHFFFAOYSA-N Synonym: ethylene glycol diethyl ether,diethyl cellosolve,ethane, 1,2-diethoxy,hisolve eme,3,6-dioxaoctane,glyme-1,diethyl glycol,2-ethoxyethyl ethyl ether,egdee,diethylether ethylenglykolu PubChem CID: 12375 IUPAC Name: 1,2-diethoxyethane SMILES: CCOCCOCC
| PubChem CID | 12375 |
|---|---|
| CAS | 629-14-1 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00009253 |
| SMILES | CCOCCOCC |
| Synonym | ethylene glycol diethyl ether,diethyl cellosolve,ethane, 1,2-diethoxy,hisolve eme,3,6-dioxaoctane,glyme-1,diethyl glycol,2-ethoxyethyl ethyl ether,egdee,diethylether ethylenglykolu |
| IUPAC Name | 1,2-diethoxyethane |
| InChI Key | LZDKZFUFMNSQCJ-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
Titanium(IV) n-butoxide, 98+%
CAS: 5593-70-4 Molecular Formula: C16H36O4Ti Molecular Weight (g/mol): 340.35 MDL Number: MFCD00009433 InChI Key: FPCJKVGGYOAWIZ-UHFFFAOYSA-N Synonym: butyl titanate,butan-1-ol; titanium,titanium n-butoxide,tetrabutyl orthotitanate,tetrabutyl titanate,1-butanol; titanium,tetra butyl orthotitanate,tetrabutyl ortho-titanate PubChem CID: 25203927 IUPAC Name: butan-1-ol;titanium SMILES: CCCCO.CCCCO.CCCCO.CCCCO.[Ti]
| PubChem CID | 25203927 |
|---|---|
| CAS | 5593-70-4 |
| Molecular Weight (g/mol) | 340.35 |
| MDL Number | MFCD00009433 |
| SMILES | CCCCO.CCCCO.CCCCO.CCCCO.[Ti] |
| Synonym | butyl titanate,butan-1-ol; titanium,titanium n-butoxide,tetrabutyl orthotitanate,tetrabutyl titanate,1-butanol; titanium,tetra butyl orthotitanate,tetrabutyl ortho-titanate |
| IUPAC Name | butan-1-ol;titanium |
| InChI Key | FPCJKVGGYOAWIZ-UHFFFAOYSA-N |
| Molecular Formula | C16H36O4Ti |
tert-Butyl Ethyl Ether, 97%
CAS: 637-92-3 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00009225 InChI Key: NUMQCACRALPSHD-UHFFFAOYSA-N Synonym: tert-butyl ethyl ether,ethyl tert-butyl ether,etbe,propane, 2-ethoxy-2-methyl,ethyl tert-butyl oxide,ether, tert-butyl ethyl,2-methyl-2-ethoxypropane,ethyl t-butyl ether,tert-butylethylether,methyl-2-ethoxypropane PubChem CID: 12512 IUPAC Name: 2-ethoxy-2-methylpropane SMILES: CCOC(C)(C)C
| PubChem CID | 12512 |
|---|---|
| CAS | 637-92-3 |
| Molecular Weight (g/mol) | 102.18 |
| MDL Number | MFCD00009225 |
| SMILES | CCOC(C)(C)C |
| Synonym | tert-butyl ethyl ether,ethyl tert-butyl ether,etbe,propane, 2-ethoxy-2-methyl,ethyl tert-butyl oxide,ether, tert-butyl ethyl,2-methyl-2-ethoxypropane,ethyl t-butyl ether,tert-butylethylether,methyl-2-ethoxypropane |
| IUPAC Name | 2-ethoxy-2-methylpropane |
| InChI Key | NUMQCACRALPSHD-UHFFFAOYSA-N |
| Molecular Formula | C6H14O |
2-(Trifluoromethyl)pyridine-5-carboxaldehyde, 95%
CAS: 386704-12-7 Molecular Formula: C7H4F3NO Molecular Weight (g/mol): 175.11 MDL Number: MFCD01862647 InChI Key: MRPAGRCGPAXOGS-UHFFFAOYSA-N Synonym: 6-trifluoromethyl pyridine-3-carboxaldehyde,6-trifluoromethyl nicotinaldehyde,2-trifluoromethyl pyridine-5-carboxaldehyde,6-trifluoromethyl pyridine-3-carbaldehyde,5-formyl-2-trifluoromethyl pyridine,3-pyridinecarboxaldehyde, 6-trifluoromethyl,6-trifluoromethyl-pyridine-3-carbaldehyde,6-trifluoromethyl-3-pyridinecarboxaldehyde,2-trifluoromethyl pyridine-5-carbaldehyde,pubchem15866 PubChem CID: 2777762 IUPAC Name: 6-(trifluoromethyl)pyridine-3-carbaldehyde SMILES: FC(F)(F)C1=NC=C(C=O)C=C1
| PubChem CID | 2777762 |
|---|---|
| CAS | 386704-12-7 |
| Molecular Weight (g/mol) | 175.11 |
| MDL Number | MFCD01862647 |
| SMILES | FC(F)(F)C1=NC=C(C=O)C=C1 |
| Synonym | 6-trifluoromethyl pyridine-3-carboxaldehyde,6-trifluoromethyl nicotinaldehyde,2-trifluoromethyl pyridine-5-carboxaldehyde,6-trifluoromethyl pyridine-3-carbaldehyde,5-formyl-2-trifluoromethyl pyridine,3-pyridinecarboxaldehyde, 6-trifluoromethyl,6-trifluoromethyl-pyridine-3-carbaldehyde,6-trifluoromethyl-3-pyridinecarboxaldehyde,2-trifluoromethyl pyridine-5-carbaldehyde,pubchem15866 |
| IUPAC Name | 6-(trifluoromethyl)pyridine-3-carbaldehyde |
| InChI Key | MRPAGRCGPAXOGS-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3NO |
4-Penten-1-ol, 98+%
CAS: 821-09-0 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.134 MDL Number: MFCD00002975 InChI Key: LQAVWYMTUMSFBE-UHFFFAOYSA-N Synonym: 4-penten-1-ol,4-pentenol,4-pentenyl alcohol,2-allylethyl alcohol,unii-w0558tqc6f,4-pentene-1-ol,4-pentenol-1,4-penten-1ol,4penten-1-ol,5-hydroxy-1-pentene PubChem CID: 13181 IUPAC Name: pent-4-en-1-ol SMILES: C=CCCCO
| PubChem CID | 13181 |
|---|---|
| CAS | 821-09-0 |
| Molecular Weight (g/mol) | 86.134 |
| MDL Number | MFCD00002975 |
| SMILES | C=CCCCO |
| Synonym | 4-penten-1-ol,4-pentenol,4-pentenyl alcohol,2-allylethyl alcohol,unii-w0558tqc6f,4-pentene-1-ol,4-pentenol-1,4-penten-1ol,4penten-1-ol,5-hydroxy-1-pentene |
| IUPAC Name | pent-4-en-1-ol |
| InChI Key | LQAVWYMTUMSFBE-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
Pyruvic acid, 98%
CAS: 127-17-3 Molecular Formula: C3H4O3 Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: pyruvic acid,pyroracemic acid,2-oxopropionic acid,acetylformic acid,alpha-ketopropionic acid,2-ketopropionic acid,2-oxopropanoate,propanoic acid, 2-oxo,2-oxo-propionic acid,2-oxopropansaeure PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(O)=O
| PubChem CID | 1060 |
|---|---|
| CAS | 127-17-3 |
| Molecular Weight (g/mol) | 88.06 |
| ChEBI | CHEBI:32816 |
| MDL Number | MFCD00002585 |
| SMILES | CC(=O)C(O)=O |
| Synonym | pyruvic acid,pyroracemic acid,2-oxopropionic acid,acetylformic acid,alpha-ketopropionic acid,2-ketopropionic acid,2-oxopropanoate,propanoic acid, 2-oxo,2-oxo-propionic acid,2-oxopropansaeure |
| IUPAC Name | 2-oxopropanoic acid |
| InChI Key | LCTONWCANYUPML-UHFFFAOYSA-N |
| Molecular Formula | C3H4O3 |
Hydrindantin dihydrate, 96%
CAS: 5950-69-6 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.29 MDL Number: MFCD00149242 InChI Key: QHVADKNWNMILPQ-HOTGVXAUSA-N Synonym: 2s-2,3,3-trihydroxy-2-2s-1,1,2-trihydroxy-3-oxoinden-2-yl inden-1-one PubChem CID: 6560392 IUPAC Name: (2S)-2,3,3-trihydroxy-2-[(2S)-1,1,2-trihydroxy-3-oxoinden-2-yl]inden-1-one SMILES: C1=CC=C2C(=C1)C(=O)C(C2(O)O)(C3(C(=O)C4=CC=CC=C4C3(O)O)O)O
| PubChem CID | 6560392 |
|---|---|
| CAS | 5950-69-6 |
| Molecular Weight (g/mol) | 358.29 |
| MDL Number | MFCD00149242 |
| SMILES | C1=CC=C2C(=C1)C(=O)C(C2(O)O)(C3(C(=O)C4=CC=CC=C4C3(O)O)O)O |
| Synonym | 2s-2,3,3-trihydroxy-2-2s-1,1,2-trihydroxy-3-oxoinden-2-yl inden-1-one |
| IUPAC Name | (2S)-2,3,3-trihydroxy-2-[(2S)-1,1,2-trihydroxy-3-oxoinden-2-yl]inden-1-one |
| InChI Key | QHVADKNWNMILPQ-HOTGVXAUSA-N |
| Molecular Formula | C18H14O8 |
Isovaleraldehyde, 98%
CAS: 590-86-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00007014 InChI Key: YGHRJJRRZDOVPD-UHFFFAOYSA-N Synonym: isovaleraldehyde,3-methylbutyraldehyde,isopentaldehyde,isovaleral,isovalerylaldehyde,isoamylaldehyde,butanal, 3-methyl,isopentanal,beta-methylbutanal,isovaleric aldehyde PubChem CID: 11552 ChEBI: CHEBI:16638 IUPAC Name: 3-methylbutanal SMILES: CC(C)CC=O
| PubChem CID | 11552 |
|---|---|
| CAS | 590-86-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:16638 |
| MDL Number | MFCD00007014 |
| SMILES | CC(C)CC=O |
| Synonym | isovaleraldehyde,3-methylbutyraldehyde,isopentaldehyde,isovaleral,isovalerylaldehyde,isoamylaldehyde,butanal, 3-methyl,isopentanal,beta-methylbutanal,isovaleric aldehyde |
| IUPAC Name | 3-methylbutanal |
| InChI Key | YGHRJJRRZDOVPD-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
2-Acetylfuran, 99%
CAS: 1192-62-7 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00003242 InChI Key: IEMMBWWQXVXBEU-UHFFFAOYSA-N Synonym: 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl PubChem CID: 14505 ChEBI: CHEBI:59983 IUPAC Name: 1-(furan-2-yl)ethanone SMILES: CC(=O)C1=CC=CO1
| PubChem CID | 14505 |
|---|---|
| CAS | 1192-62-7 |
| Molecular Weight (g/mol) | 110.112 |
| ChEBI | CHEBI:59983 |
| MDL Number | MFCD00003242 |
| SMILES | CC(=O)C1=CC=CO1 |
| Synonym | 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl |
| IUPAC Name | 1-(furan-2-yl)ethanone |
| InChI Key | IEMMBWWQXVXBEU-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
15-Crown-5, 98%
CAS: 33100-27-5 Molecular Formula: C10H20O5 Molecular Weight (g/mol): 220.26 MDL Number: MFCD00005110 InChI Key: VFTFKUDGYRBSAL-UHFFFAOYSA-N Synonym: 15-crown-5,15-crown-5 ether,15-crown 5-ether,1,4,10,13-pentaoxacyclopentadecane,ccris 3586,15-crown 5,crown ether 15-crown-5,5-19-12-00252 beilstein handbook reference,ksc917c1b PubChem CID: 36336 ChEBI: CHEBI:32401 IUPAC Name: 1,4,7,10,13-pentaoxacyclopentadecane SMILES: C1COCCOCCOCCOCCO1
| PubChem CID | 36336 |
|---|---|
| CAS | 33100-27-5 |
| Molecular Weight (g/mol) | 220.26 |
| ChEBI | CHEBI:32401 |
| MDL Number | MFCD00005110 |
| SMILES | C1COCCOCCOCCOCCO1 |
| Synonym | 15-crown-5,15-crown-5 ether,15-crown 5-ether,1,4,10,13-pentaoxacyclopentadecane,ccris 3586,15-crown 5,crown ether 15-crown-5,5-19-12-00252 beilstein handbook reference,ksc917c1b |
| IUPAC Name | 1,4,7,10,13-pentaoxacyclopentadecane |
| InChI Key | VFTFKUDGYRBSAL-UHFFFAOYSA-N |
| Molecular Formula | C10H20O5 |
Triethyl orthoformate, 98%, anhydrous, AcroSeal™
CAS: 122-51-0 Molecular Formula: C7H16O3 Molecular Weight (g/mol): 148.2 InChI Key: GKASDNZWUGIAMG-UHFFFAOYSA-N Synonym: triethyl orthoformate,triethoxymethane,ethyl orthoformate,aethon,ethone,diethoxymethoxy ethane,methane, triethoxy,ethyl formate ortho,orthoformic acid triethyl ester,orthomravencan ethylnaty PubChem CID: 31214 IUPAC Name: diethoxymethoxyethane SMILES: CCOC(OCC)OCC
| PubChem CID | 31214 |
|---|---|
| CAS | 122-51-0 |
| Molecular Weight (g/mol) | 148.2 |
| SMILES | CCOC(OCC)OCC |
| Synonym | triethyl orthoformate,triethoxymethane,ethyl orthoformate,aethon,ethone,diethoxymethoxy ethane,methane, triethoxy,ethyl formate ortho,orthoformic acid triethyl ester,orthomravencan ethylnaty |
| IUPAC Name | diethoxymethoxyethane |
| InChI Key | GKASDNZWUGIAMG-UHFFFAOYSA-N |
| Molecular Formula | C7H16O3 |