Organooxygen compounds
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Bis(2,4-pentanedionato)manganese(II) Dihydrate 97.0+%, TCI America™
CAS: 14024-58-9 Molecular Formula: C10H14MnO4 Molecular Weight (g/mol): 253.16 MDL Number: MFCD00000022 MFCD09998212 InChI Key: ZQZQURFYFJBOCE-FDGPNNRMSA-L Synonym: bis 4-hydroxypent-3-en-2-one dihydrate manganese PubChem CID: 54669727 IUPAC Name: manganese(2+) bis((2Z)-4-oxopent-2-en-2-olate) SMILES: [Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
| PubChem CID | 54669727 |
|---|---|
| CAS | 14024-58-9 |
| Molecular Weight (g/mol) | 253.16 |
| MDL Number | MFCD00000022 MFCD09998212 |
| SMILES | [Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
| Synonym | bis 4-hydroxypent-3-en-2-one dihydrate manganese |
| IUPAC Name | manganese(2+) bis((2Z)-4-oxopent-2-en-2-olate) |
| InChI Key | ZQZQURFYFJBOCE-FDGPNNRMSA-L |
| Molecular Formula | C10H14MnO4 |
Methoxyacetone 96.0+%, TCI America™
CAS: 5878-19-3 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00008768 InChI Key: CUZLJOLBIRPEFB-UHFFFAOYSA-N Synonym: methoxyacetone,methoxy-2-propanone,2-propanone, 1-methoxy,1-methoxy-2-propanone,1-methoxyacetone,methoxyaceton,methoxymethyl methyl ketone,methoxy acetone,ch3coch2och3 PubChem CID: 22172 IUPAC Name: 1-methoxypropan-2-one SMILES: COCC(C)=O
| PubChem CID | 22172 |
|---|---|
| CAS | 5878-19-3 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00008768 |
| SMILES | COCC(C)=O |
| Synonym | methoxyacetone,methoxy-2-propanone,2-propanone, 1-methoxy,1-methoxy-2-propanone,1-methoxyacetone,methoxyaceton,methoxymethyl methyl ketone,methoxy acetone,ch3coch2och3 |
| IUPAC Name | 1-methoxypropan-2-one |
| InChI Key | CUZLJOLBIRPEFB-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |
2-Mercaptoethanol 99.0+%, TCI America™
CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 IUPAC Name: 2-sulfanylethan-1-ol SMILES: OCCS
| PubChem CID | 1567 |
|---|---|
| CAS | 60-24-2 |
| Molecular Weight (g/mol) | 78.13 |
| ChEBI | CHEBI:41218 |
| MDL Number | MFCD00004890 |
| SMILES | OCCS |
| Synonym | 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan |
| IUPAC Name | 2-sulfanylethan-1-ol |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
8-Bromo-1-octanol 90.0+%, TCI America™
CAS: 50816-19-8 Molecular Formula: C8H17BrO Molecular Weight (g/mol): 209.127 MDL Number: MFCD00010388 InChI Key: GMXIEASXPUEOTG-UHFFFAOYSA-N Synonym: 8-bromo-1-octanol,1-octanol, 8-bromo,8-bromooctanol,octamethylene bromohydrin,8-bromo octanol,1-bromooctan-8-ol,8-bromo-1-actanol,8-bromooctane-1-ol,1-bromo-octan-8-ol,8-bromo-octan-1-ol PubChem CID: 162607 IUPAC Name: 8-bromooctan-1-ol SMILES: C(CCCCBr)CCCO
| PubChem CID | 162607 |
|---|---|
| CAS | 50816-19-8 |
| Molecular Weight (g/mol) | 209.127 |
| MDL Number | MFCD00010388 |
| SMILES | C(CCCCBr)CCCO |
| Synonym | 8-bromo-1-octanol,1-octanol, 8-bromo,8-bromooctanol,octamethylene bromohydrin,8-bromo octanol,1-bromooctan-8-ol,8-bromo-1-actanol,8-bromooctane-1-ol,1-bromo-octan-8-ol,8-bromo-octan-1-ol |
| IUPAC Name | 8-bromooctan-1-ol |
| InChI Key | GMXIEASXPUEOTG-UHFFFAOYSA-N |
| Molecular Formula | C8H17BrO |
1-Bromo-3,3,3-trifluoroacetone 95.0+%, TCI America™
CAS: 431-35-6 Molecular Formula: C3H2BrF3O Molecular Weight (g/mol): 190.95 MDL Number: MFCD00039237 InChI Key: ONZQYZKCUHFORE-UHFFFAOYSA-N Synonym: 3-bromo-1,1,1-trifluoroacetone,1-bromo-3,3,3-trifluoroacetone,bromotrifluoroacetone,3-bromo-1,1,1-trifluoro-2-propanone,3-bromo-1,1,1-trifluoropropanone,1-bromo-3,3,3-trifluoro-2-propanone,2-propanone, 3-bromo-1,1,1-trifluoro,1,1,1-trifluoro-3-bromopropanone,3-bromo-1,1,1-trifluoro-propan-2-one,bromotrifloroacetone PubChem CID: 79008 IUPAC Name: 3-bromo-1,1,1-trifluoropropan-2-one SMILES: FC(F)(F)C(=O)CBr
| PubChem CID | 79008 |
|---|---|
| CAS | 431-35-6 |
| Molecular Weight (g/mol) | 190.95 |
| MDL Number | MFCD00039237 |
| SMILES | FC(F)(F)C(=O)CBr |
| Synonym | 3-bromo-1,1,1-trifluoroacetone,1-bromo-3,3,3-trifluoroacetone,bromotrifluoroacetone,3-bromo-1,1,1-trifluoro-2-propanone,3-bromo-1,1,1-trifluoropropanone,1-bromo-3,3,3-trifluoro-2-propanone,2-propanone, 3-bromo-1,1,1-trifluoro,1,1,1-trifluoro-3-bromopropanone,3-bromo-1,1,1-trifluoro-propan-2-one,bromotrifloroacetone |
| IUPAC Name | 3-bromo-1,1,1-trifluoropropan-2-one |
| InChI Key | ONZQYZKCUHFORE-UHFFFAOYSA-N |
| Molecular Formula | C3H2BrF3O |
Bis(2,2,2-trifluoroethyl) Ether 99.0+%, TCI America™
CAS: 333-36-8 Molecular Formula: C4H4F6O Molecular Weight (g/mol): 182.065 MDL Number: MFCD00010604 InChI Key: KGPPDNUWZNWPSI-UHFFFAOYSA-N Synonym: 2,2,2-Trifluoroethyl Ether PubChem CID: 9528 IUPAC Name: 1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)ethane SMILES: C(C(F)(F)F)OCC(F)(F)F
| PubChem CID | 9528 |
|---|---|
| CAS | 333-36-8 |
| Molecular Weight (g/mol) | 182.065 |
| MDL Number | MFCD00010604 |
| SMILES | C(C(F)(F)F)OCC(F)(F)F |
| Synonym | 2,2,2-Trifluoroethyl Ether |
| IUPAC Name | 1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)ethane |
| InChI Key | KGPPDNUWZNWPSI-UHFFFAOYSA-N |
| Molecular Formula | C4H4F6O |
5-Bromo-2-furaldehyde 98.0+%, TCI America™
CAS: 1899-24-7 Molecular Formula: C5H3BrO2 Molecular Weight (g/mol): 174.98 MDL Number: MFCD00159501 InChI Key: WJTFHWXMITZNHS-UHFFFAOYSA-N Synonym: 5-bromo-2-furaldehyde,5-bromofurfural,5-bromo-2-furfural,5-bromofuran-2-carboxaldehyde,5-bromofurancarboxaldehyde,2-furancarboxaldehyde, 5-bromo,5-bromofuraldehyde,5-bromo-furan-2-carbaldehyde,2-furaldehyde, 5-bromo,5-bromo-furfural PubChem CID: 600328 IUPAC Name: 5-bromofuran-2-carbaldehyde SMILES: BrC1=CC=C(O1)C=O
| PubChem CID | 600328 |
|---|---|
| CAS | 1899-24-7 |
| Molecular Weight (g/mol) | 174.98 |
| MDL Number | MFCD00159501 |
| SMILES | BrC1=CC=C(O1)C=O |
| Synonym | 5-bromo-2-furaldehyde,5-bromofurfural,5-bromo-2-furfural,5-bromofuran-2-carboxaldehyde,5-bromofurancarboxaldehyde,2-furancarboxaldehyde, 5-bromo,5-bromofuraldehyde,5-bromo-furan-2-carbaldehyde,2-furaldehyde, 5-bromo,5-bromo-furfural |
| IUPAC Name | 5-bromofuran-2-carbaldehyde |
| InChI Key | WJTFHWXMITZNHS-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrO2 |
5-Hydroxymethyl-2-furaldehyde (stabilized with Water) 95.0+%, TCI America™
CAS: 67-47-0 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.111 MDL Number: MFCD00003234 InChI Key: NOEGNKMFWQHSLB-UHFFFAOYSA-N Synonym: 5-hydroxymethylfurfural,5-hydroxymethyl-2-furaldehyde,5-hydroxymethyl furfural,5-hydroxymethyl furan-2-carbaldehyde,hydroxymethylfurfural,5-hydroxymethyl-2-furfural,5-oxymethylfurfurole,5-hydroxymethylfuraldehyde,hydroxymethylfurfurole PubChem CID: 237332 ChEBI: CHEBI:412516 IUPAC Name: 5-(hydroxymethyl)furan-2-carbaldehyde SMILES: C1=C(OC(=C1)C=O)CO
| PubChem CID | 237332 |
|---|---|
| CAS | 67-47-0 |
| Molecular Weight (g/mol) | 126.111 |
| ChEBI | CHEBI:412516 |
| MDL Number | MFCD00003234 |
| SMILES | C1=C(OC(=C1)C=O)CO |
| Synonym | 5-hydroxymethylfurfural,5-hydroxymethyl-2-furaldehyde,5-hydroxymethyl furfural,5-hydroxymethyl furan-2-carbaldehyde,hydroxymethylfurfural,5-hydroxymethyl-2-furfural,5-oxymethylfurfurole,5-hydroxymethylfuraldehyde,hydroxymethylfurfurole |
| IUPAC Name | 5-(hydroxymethyl)furan-2-carbaldehyde |
| InChI Key | NOEGNKMFWQHSLB-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
Pentaethylene Glycol 95.0+%, TCI America™
CAS: 4792-15-8 Molecular Formula: C10H22O6 Molecular Weight (g/mol): 238.28 MDL Number: MFCD00002878 InChI Key: JLFNLZLINWHATN-UHFFFAOYSA-N Synonym: pentaethylene glycol,3,6,9,12-tetraoxatetradecane-1,14-diol,pentaethyleneglycol,pentaglycol,ho ch2ch2o 5h,3,6,9,12-tetraoxatetradocane-1,14-diol,2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethanol,dsstox_cid_7579,dsstox_rid_78510,dsstox_gsid_27579 PubChem CID: 62551 ChEBI: CHEBI:39631 IUPAC Name: 2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCO)O
| PubChem CID | 62551 |
|---|---|
| CAS | 4792-15-8 |
| Molecular Weight (g/mol) | 238.28 |
| ChEBI | CHEBI:39631 |
| MDL Number | MFCD00002878 |
| SMILES | C(COCCOCCOCCOCCO)O |
| Synonym | pentaethylene glycol,3,6,9,12-tetraoxatetradecane-1,14-diol,pentaethyleneglycol,pentaglycol,ho ch2ch2o 5h,3,6,9,12-tetraoxatetradocane-1,14-diol,2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethanol,dsstox_cid_7579,dsstox_rid_78510,dsstox_gsid_27579 |
| IUPAC Name | 2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | JLFNLZLINWHATN-UHFFFAOYSA-N |
| Molecular Formula | C10H22O6 |
1-Propoxy-2-propanol (contains 2-Isopropoxy-1-propanol) 93.0+%, TCI America™
CAS: 1569-01-3 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00192420 InChI Key: FENFUOGYJVOCRY-UHFFFAOYNA-N Synonym: Propylene Glycol Monopropyl Ether PubChem CID: 15286 IUPAC Name: 1-propoxypropan-2-ol SMILES: CCCOCC(C)O
| PubChem CID | 15286 |
|---|---|
| CAS | 1569-01-3 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00192420 |
| SMILES | CCCOCC(C)O |
| Synonym | Propylene Glycol Monopropyl Ether |
| IUPAC Name | 1-propoxypropan-2-ol |
| InChI Key | FENFUOGYJVOCRY-UHFFFAOYNA-N |
| Molecular Formula | C6H14O2 |
(S)-(-)-2-Methyl-1-butanol 98.0+%, TCI America™
CAS: 1565-80-6 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00064299 InChI Key: QPRQEDXDYOZYLA-YFKPBYRVSA-N Synonym: s---2-methyl-1-butanol,s-2-methyl-1-butanol,s-2-methylbutan-1-ol,1-butanol, 2-methyl-, 2s,2s-2-methylbutan-1-ol,unii-ii2qjb35ic,1-butanol, 2-methyl-, s,2s-2-methyl-1-butanol,s---2-methylbutanol,2-methyl-1-butanol,- PubChem CID: 2723602 ChEBI: CHEBI:50625 IUPAC Name: (2S)-2-methylbutan-1-ol SMILES: CCC(C)CO
| PubChem CID | 2723602 |
|---|---|
| CAS | 1565-80-6 |
| Molecular Weight (g/mol) | 88.15 |
| ChEBI | CHEBI:50625 |
| MDL Number | MFCD00064299 |
| SMILES | CCC(C)CO |
| Synonym | s---2-methyl-1-butanol,s-2-methyl-1-butanol,s-2-methylbutan-1-ol,1-butanol, 2-methyl-, 2s,2s-2-methylbutan-1-ol,unii-ii2qjb35ic,1-butanol, 2-methyl-, s,2s-2-methyl-1-butanol,s---2-methylbutanol,2-methyl-1-butanol,- |
| IUPAC Name | (2S)-2-methylbutan-1-ol |
| InChI Key | QPRQEDXDYOZYLA-YFKPBYRVSA-N |
| Molecular Formula | C5H12O |
1-(p-Tolyl)ethanol 97.0+%, TCI America™
CAS: 536-50-5 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00016860 InChI Key: JESIHYIJKKUWIS-UHFFFAOYSA-N Synonym: 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol PubChem CID: 10817 IUPAC Name: 1-(4-methylphenyl)ethanol SMILES: CC1=CC=C(C=C1)C(C)O
| PubChem CID | 10817 |
|---|---|
| CAS | 536-50-5 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00016860 |
| SMILES | CC1=CC=C(C=C1)C(C)O |
| Synonym | 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol |
| IUPAC Name | 1-(4-methylphenyl)ethanol |
| InChI Key | JESIHYIJKKUWIS-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
Phenacyl Bromide 98.0+%, TCI America™
CAS: 70-11-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.047 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 6259 |
|---|---|
| CAS | 70-11-1 |
| Molecular Weight (g/mol) | 199.047 |
| ChEBI | CHEBI:51846 |
| MDL Number | MFCD00000195 |
| SMILES | C1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo |
| IUPAC Name | 2-bromo-1-phenylethanone |
| InChI Key | LIGACIXOYTUXAW-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO |
4-Phenyl-3-butyn-2-one 97.0+%, TCI America™
CAS: 1817-57-8 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00008776 InChI Key: UPEUQDJSUFHFQP-UHFFFAOYSA-N Synonym: 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one PubChem CID: 74555 ChEBI: CHEBI:51731 IUPAC Name: 4-phenylbut-3-yn-2-one SMILES: CC(=O)C#CC1=CC=CC=C1
| PubChem CID | 74555 |
|---|---|
| CAS | 1817-57-8 |
| Molecular Weight (g/mol) | 144.173 |
| ChEBI | CHEBI:51731 |
| MDL Number | MFCD00008776 |
| SMILES | CC(=O)C#CC1=CC=CC=C1 |
| Synonym | 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one |
| IUPAC Name | 4-phenylbut-3-yn-2-one |
| InChI Key | UPEUQDJSUFHFQP-UHFFFAOYSA-N |
| Molecular Formula | C10H8O |
trans-2-Pentenal 95.0+%, TCI America™
CAS: 1576-87-0 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00009615 InChI Key: DTCCTIQRPGSLPT-ONEGZZNKSA-N Synonym: trans-2-pentenal,2-pentenal,e-2-pentenal,e-pent-2-enal,3-ethylacrolein,pent-2-enal,2-pentenal, e,2-e-pentenal,3-ethyl-2-propenal,e-pent-2-en-1-al PubChem CID: 5364752 IUPAC Name: (E)-pent-2-enal SMILES: CCC=CC=O
| PubChem CID | 5364752 |
|---|---|
| CAS | 1576-87-0 |
| Molecular Weight (g/mol) | 84.118 |
| MDL Number | MFCD00009615 |
| SMILES | CCC=CC=O |
| Synonym | trans-2-pentenal,2-pentenal,e-2-pentenal,e-pent-2-enal,3-ethylacrolein,pent-2-enal,2-pentenal, e,2-e-pentenal,3-ethyl-2-propenal,e-pent-2-en-1-al |
| IUPAC Name | (E)-pent-2-enal |
| InChI Key | DTCCTIQRPGSLPT-ONEGZZNKSA-N |
| Molecular Formula | C5H8O |