Organooxygen compounds
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Emodin 96.0+%, TCI America™
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CAS: 518-82-1 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00001207 InChI Key: RHMXXJGYXNZAPX-UHFFFAOYSA-N Synonym: emodin,schuttgelb,emodol,frangula emodin,rheum emodin,frangulic acid,3-methyl-1,6,8-trihydroxyanthraquinone,archin,persian berry lake,1,3,8-trihydroxy-6-methyl-9,10-anthraquinone PubChem CID: 3220 ChEBI: CHEBI:42223 IUPAC Name: 1,3,8-trihydroxy-6-methylanthracene-9,10-dione SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O
| PubChem CID | 3220 |
|---|---|
| CAS | 518-82-1 |
| Molecular Weight (g/mol) | 270.24 |
| ChEBI | CHEBI:42223 |
| MDL Number | MFCD00001207 |
| SMILES | CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O |
| Synonym | emodin,schuttgelb,emodol,frangula emodin,rheum emodin,frangulic acid,3-methyl-1,6,8-trihydroxyanthraquinone,archin,persian berry lake,1,3,8-trihydroxy-6-methyl-9,10-anthraquinone |
| IUPAC Name | 1,3,8-trihydroxy-6-methylanthracene-9,10-dione |
| InChI Key | RHMXXJGYXNZAPX-UHFFFAOYSA-N |
| Molecular Formula | C15H10O5 |
3-Methyl-3-pentanol 98.0+%, TCI America™
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CAS: 77-74-7 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.177 MDL Number: MFCD00004483 InChI Key: FRDAATYAJDYRNW-UHFFFAOYSA-N Synonym: Diethylmethylcarbinol PubChem CID: 6493 IUPAC Name: 3-methylpentan-3-ol SMILES: CCC(C)(CC)O
| PubChem CID | 6493 |
|---|---|
| CAS | 77-74-7 |
| Molecular Weight (g/mol) | 102.177 |
| MDL Number | MFCD00004483 |
| SMILES | CCC(C)(CC)O |
| Synonym | Diethylmethylcarbinol |
| IUPAC Name | 3-methylpentan-3-ol |
| InChI Key | FRDAATYAJDYRNW-UHFFFAOYSA-N |
| Molecular Formula | C6H14O |
4-(Diethylamino)salicylaldehyde 98.0+%, TCI America™
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CAS: 17754-90-4 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.246 MDL Number: MFCD00003326 InChI Key: XFVZSRRZZNLWBW-UHFFFAOYSA-N Synonym: 4-diethylamino salicylaldehyde,4-diethylamino-2-hydroxybenzaldehyde,4-diethylaminosalicylaldehyde,4-n,n-diethylamino salicylaldehyde,benzaldehyde, 4-diethylamino-2-hydroxy,p-diethylamino salicylaldehyde,unii-ou5nfu4681,2-hydroxy-4-diethylaminobenzaldehyde,4-n,n-diethylaminosalicylic aldehyde,4-diethylamino-2-hydroxy-benzaldehyde PubChem CID: 87293 IUPAC Name: 4-(diethylamino)-2-hydroxybenzaldehyde SMILES: CCN(CC)C1=CC(=C(C=C1)C=O)O
| PubChem CID | 87293 |
|---|---|
| CAS | 17754-90-4 |
| Molecular Weight (g/mol) | 193.246 |
| MDL Number | MFCD00003326 |
| SMILES | CCN(CC)C1=CC(=C(C=C1)C=O)O |
| Synonym | 4-diethylamino salicylaldehyde,4-diethylamino-2-hydroxybenzaldehyde,4-diethylaminosalicylaldehyde,4-n,n-diethylamino salicylaldehyde,benzaldehyde, 4-diethylamino-2-hydroxy,p-diethylamino salicylaldehyde,unii-ou5nfu4681,2-hydroxy-4-diethylaminobenzaldehyde,4-n,n-diethylaminosalicylic aldehyde,4-diethylamino-2-hydroxy-benzaldehyde |
| IUPAC Name | 4-(diethylamino)-2-hydroxybenzaldehyde |
| InChI Key | XFVZSRRZZNLWBW-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO2 |
Isovanillin 98.0+%, TCI America™
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CAS: 621-59-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00003369 InChI Key: JVTZFYYHCGSXJV-UHFFFAOYSA-N Synonym: isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde PubChem CID: 12127 IUPAC Name: 3-hydroxy-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)O
| PubChem CID | 12127 |
|---|---|
| CAS | 621-59-0 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00003369 |
| SMILES | COC1=C(C=C(C=C1)C=O)O |
| Synonym | isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde |
| IUPAC Name | 3-hydroxy-4-methoxybenzaldehyde |
| InChI Key | JVTZFYYHCGSXJV-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Allyl Ether 98.0+%, TCI America™
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CAS: 557-40-4 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00008650 InChI Key: ATVJXMYDOSMEPO-UHFFFAOYSA-N Synonym: Diallyl Ether PubChem CID: 11194 IUPAC Name: 3-prop-2-enoxyprop-1-ene SMILES: C=CCOCC=C
| PubChem CID | 11194 |
|---|---|
| CAS | 557-40-4 |
| Molecular Weight (g/mol) | 98.145 |
| MDL Number | MFCD00008650 |
| SMILES | C=CCOCC=C |
| Synonym | Diallyl Ether |
| IUPAC Name | 3-prop-2-enoxyprop-1-ene |
| InChI Key | ATVJXMYDOSMEPO-UHFFFAOYSA-N |
| Molecular Formula | C6H10O |
Ketanserin 98.0+%, TCI America™
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CAS: 74050-98-9 Molecular Formula: C22H22FN3O3 Molecular Weight (g/mol): 395.434 MDL Number: MFCD00083392 InChI Key: FPCCSQOGAWCVBH-UHFFFAOYSA-N Synonym: 3-[2-[4-(4-Fluorobenzoyl)-1-piperidinyl]ethyl]-2,4(1H,3H)-quinazolinedione PubChem CID: 3822 ChEBI: CHEBI:6123 IUPAC Name: 3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione SMILES: C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O
| PubChem CID | 3822 |
|---|---|
| CAS | 74050-98-9 |
| Molecular Weight (g/mol) | 395.434 |
| ChEBI | CHEBI:6123 |
| MDL Number | MFCD00083392 |
| SMILES | C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O |
| Synonym | 3-[2-[4-(4-Fluorobenzoyl)-1-piperidinyl]ethyl]-2,4(1H,3H)-quinazolinedione |
| IUPAC Name | 3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione |
| InChI Key | FPCCSQOGAWCVBH-UHFFFAOYSA-N |
| Molecular Formula | C22H22FN3O3 |
LabChem, Inc. Ascorbic Acid, Reagent Grade, LabChem™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 IUPAC Name: (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| IUPAC Name | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
L-(-)-Sorbose 98.0+%, TCI America™
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CAS: 87-79-6 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00151097 InChI Key: BJHIKXHVCXFQLS-OTWZMJIISA-N Synonym: l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose PubChem CID: 6904 ChEBI: CHEBI:13172 IUPAC Name: (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 6904 |
|---|---|
| CAS | 87-79-6 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:13172 |
| MDL Number | MFCD00151097 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose |
| IUPAC Name | (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-OTWZMJIISA-N |
| Molecular Formula | C6H12O6 |
(1R,2R)-1,2-Cyclohexanedimethanol 98.0+%, TCI America™
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CAS: 65376-05-8 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD16660860 InChI Key: XDODWINGEHBYRT-YUMQZZPRSA-N Synonym: (1R,2R)-1,2-Bis(hydroxymethyl)cyclohexane PubChem CID: 11217323 IUPAC Name: [(1R,2R)-2-(hydroxymethyl)cyclohexyl]methanol SMILES: C1CCC(C(C1)CO)CO
| PubChem CID | 11217323 |
|---|---|
| CAS | 65376-05-8 |
| Molecular Weight (g/mol) | 144.214 |
| MDL Number | MFCD16660860 |
| SMILES | C1CCC(C(C1)CO)CO |
| Synonym | (1R,2R)-1,2-Bis(hydroxymethyl)cyclohexane |
| IUPAC Name | [(1R,2R)-2-(hydroxymethyl)cyclohexyl]methanol |
| InChI Key | XDODWINGEHBYRT-YUMQZZPRSA-N |
| Molecular Formula | C8H16O2 |
6-Bromo-1-hexanol 95.0+%, TCI America™
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CAS: 4286-55-9 Molecular Formula: C6H13BrO Molecular Weight (g/mol): 181.07 MDL Number: MFCD00002983 InChI Key: FCMCSZXRVWDVAW-UHFFFAOYSA-N Synonym: 6-bromo-1-hexanol,6-bromohexanol,1-hexanol, 6-bromo,6-bromo-hexan-1-ol,hexamethylene bromohydrin,6-bromo-hexanol,6-bromo-l-hexanol,1-bromo-6-hexanol,1-bromohexan-6-ol,6-hydroxyhexyl bromide PubChem CID: 77970 IUPAC Name: 6-bromohexan-1-ol SMILES: OCCCCCCBr
| PubChem CID | 77970 |
|---|---|
| CAS | 4286-55-9 |
| Molecular Weight (g/mol) | 181.07 |
| MDL Number | MFCD00002983 |
| SMILES | OCCCCCCBr |
| Synonym | 6-bromo-1-hexanol,6-bromohexanol,1-hexanol, 6-bromo,6-bromo-hexan-1-ol,hexamethylene bromohydrin,6-bromo-hexanol,6-bromo-l-hexanol,1-bromo-6-hexanol,1-bromohexan-6-ol,6-hydroxyhexyl bromide |
| IUPAC Name | 6-bromohexan-1-ol |
| InChI Key | FCMCSZXRVWDVAW-UHFFFAOYSA-N |
| Molecular Formula | C6H13BrO |
4'-Aminobenzo-15-crown 5-Ether 97.0+%, TCI America™
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CAS: 60835-71-4 Molecular Formula: C14H21NO5 Molecular Weight (g/mol): 283.324 MDL Number: MFCD00068686 InChI Key: CQNGAZMLFIMLQN-UHFFFAOYSA-N Synonym: 2,3-(4-Aminobenzo)-1,4,7,10,13-pentaoxacyclopentadec-2-ene PubChem CID: 2724797 IUPAC Name: 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine SMILES: C1COCCOC2=C(C=C(C=C2)N)OCCOCCO1
| PubChem CID | 2724797 |
|---|---|
| CAS | 60835-71-4 |
| Molecular Weight (g/mol) | 283.324 |
| MDL Number | MFCD00068686 |
| SMILES | C1COCCOC2=C(C=C(C=C2)N)OCCOCCO1 |
| Synonym | 2,3-(4-Aminobenzo)-1,4,7,10,13-pentaoxacyclopentadec-2-ene |
| IUPAC Name | 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine |
| InChI Key | CQNGAZMLFIMLQN-UHFFFAOYSA-N |
| Molecular Formula | C14H21NO5 |
3-Ethoxybenzaldehyde 98.0+%, TCI America™
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CAS: 22924-15-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00016606 InChI Key: QZMGMXBYJZVAJN-UHFFFAOYSA-N Synonym: m-ethoxybenzaldehyde,benzaldehyde, 3-ethoxy,3-ethoxy-benzaldehyde,benzaldehyde, m-ethoxy,3-ethoxy benzaldehyde,3-ethoxybenzaldehdye,pubchem13132,acmc-209fzo,intermediates-zcf02615,3-ethoxybenzaldehyde PubChem CID: 89908 IUPAC Name: 3-ethoxybenzaldehyde SMILES: CCOC1=CC=CC(=C1)C=O
| PubChem CID | 89908 |
|---|---|
| CAS | 22924-15-8 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00016606 |
| SMILES | CCOC1=CC=CC(=C1)C=O |
| Synonym | m-ethoxybenzaldehyde,benzaldehyde, 3-ethoxy,3-ethoxy-benzaldehyde,benzaldehyde, m-ethoxy,3-ethoxy benzaldehyde,3-ethoxybenzaldehdye,pubchem13132,acmc-209fzo,intermediates-zcf02615,3-ethoxybenzaldehyde |
| IUPAC Name | 3-ethoxybenzaldehyde |
| InChI Key | QZMGMXBYJZVAJN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Decaethylene Glycol 90.0+%, TCI America™
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CAS: 5579-66-8 Molecular Formula: C20H42O11 Molecular Weight (g/mol): 458.545 MDL Number: MFCD00698693 InChI Key: DTPCFIHYWYONMD-UHFFFAOYSA-N PubChem CID: 79689 ChEBI: CHEBI:46550 IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
| PubChem CID | 79689 |
|---|---|
| CAS | 5579-66-8 |
| Molecular Weight (g/mol) | 458.545 |
| ChEBI | CHEBI:46550 |
| MDL Number | MFCD00698693 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCOCCOCCO)O |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | DTPCFIHYWYONMD-UHFFFAOYSA-N |
| Molecular Formula | C20H42O11 |
15-Crown 5-Ether 97.0+%, TCI America™
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CAS: 33100-27-5 Molecular Formula: C10H20O5 Molecular Weight (g/mol): 220.265 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) | 220.265 |
| 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 |
4,8-Bis(2-ethylhexyloxy)benzo[1,2-b:4,5-b']dithiophene 95.0+%, TCI America™
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CAS: 1160823-77-7 Molecular Formula: C26H38O2S2 Molecular Weight (g/mol): 446.708 MDL Number: MFCD17018551 InChI Key: HATOWNJGYIVNBU-UHFFFAOYSA-N PubChem CID: 53486668 IUPAC Name: 4,8-bis(2-ethylhexoxy)thieno[2,3-f][1]benzothiole SMILES: CCCCC(CC)COC1=C2C=CSC2=C(C3=C1SC=C3)OCC(CC)CCCC
| PubChem CID | 53486668 |
|---|---|
| CAS | 1160823-77-7 |
| Molecular Weight (g/mol) | 446.708 |
| MDL Number | MFCD17018551 |
| SMILES | CCCCC(CC)COC1=C2C=CSC2=C(C3=C1SC=C3)OCC(CC)CCCC |
| IUPAC Name | 4,8-bis(2-ethylhexoxy)thieno[2,3-f][1]benzothiole |
| InChI Key | HATOWNJGYIVNBU-UHFFFAOYSA-N |
| Molecular Formula | C26H38O2S2 |