Organooxygen compounds
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2,3-Dimethylanthraquinone 95.0+%, TCI America™
CAS: 6531-35-7 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 InChI Key: KIJPZYXCIHZVGP-UHFFFAOYSA-N PubChem CID: 81019 IUPAC Name: 2,3-dimethylanthracene-9,10-dione SMILES: CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C
| PubChem CID | 81019 |
|---|---|
| CAS | 6531-35-7 |
| Molecular Weight (g/mol) | 236.27 |
| SMILES | CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C |
| IUPAC Name | 2,3-dimethylanthracene-9,10-dione |
| InChI Key | KIJPZYXCIHZVGP-UHFFFAOYSA-N |
| Molecular Formula | C16H12O2 |
Allyl Methyl Ether 97.0+%, TCI America™
CAS: 627-40-7 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00008649 InChI Key: FASUFOTUSHAIHG-UHFFFAOYSA-N Synonym: allyl methyl ether,1-propene, 3-methoxy,3-methoxy-1-propene,ether, allyl methyl,3-methoxypropene,methyl allyl ether,allylmethylether,4-oxapent-1-ene,1-methoxy-2-propene,methylallyl ether PubChem CID: 69392 IUPAC Name: 3-methoxyprop-1-ene SMILES: COCC=C
| PubChem CID | 69392 |
|---|---|
| CAS | 627-40-7 |
| Molecular Weight (g/mol) | 72.11 |
| MDL Number | MFCD00008649 |
| SMILES | COCC=C |
| Synonym | allyl methyl ether,1-propene, 3-methoxy,3-methoxy-1-propene,ether, allyl methyl,3-methoxypropene,methyl allyl ether,allylmethylether,4-oxapent-1-ene,1-methoxy-2-propene,methylallyl ether |
| IUPAC Name | 3-methoxyprop-1-ene |
| InChI Key | FASUFOTUSHAIHG-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
5-Hydroxy-2-pentanone (mixture of monomer and dimer) 96.0+%, TCI America™
CAS: 1071-73-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00002961 InChI Key: JSHPTIGHEWEXRW-UHFFFAOYSA-N Synonym: 3-Acetyl-1-propanol PubChem CID: 14066 IUPAC Name: 5-hydroxypentan-2-one SMILES: CC(=O)CCCO
| PubChem CID | 14066 |
|---|---|
| CAS | 1071-73-4 |
| Molecular Weight (g/mol) | 102.133 |
| MDL Number | MFCD00002961 |
| SMILES | CC(=O)CCCO |
| Synonym | 3-Acetyl-1-propanol |
| IUPAC Name | 5-hydroxypentan-2-one |
| InChI Key | JSHPTIGHEWEXRW-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Hexaethylene Glycol 98.0+%, TCI America™
CAS: 2615-15-8 Molecular Formula: C12H26O7 Molecular Weight (g/mol): 282.333 MDL Number: MFCD00002877 InChI Key: IIRDTKBZINWQAW-UHFFFAOYSA-N Synonym: hexaethylene glycol,hexagol,3,6,9,12,15-pentaoxaheptadecane-1,17-diol,hexaoxyethylene glycol,peg-6,polyethylene glycol 300,polyoxyethylene 6,hexaethyleneglycol,2-2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethoxy ethanol,ho-peg6-oh PubChem CID: 17472 ChEBI: CHEBI:49793 IUPAC Name: 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCO)O
| PubChem CID | 17472 |
|---|---|
| CAS | 2615-15-8 |
| Molecular Weight (g/mol) | 282.333 |
| ChEBI | CHEBI:49793 |
| MDL Number | MFCD00002877 |
| SMILES | C(COCCOCCOCCOCCOCCO)O |
| Synonym | hexaethylene glycol,hexagol,3,6,9,12,15-pentaoxaheptadecane-1,17-diol,hexaoxyethylene glycol,peg-6,polyethylene glycol 300,polyoxyethylene 6,hexaethyleneglycol,2-2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethoxy ethanol,ho-peg6-oh |
| IUPAC Name | 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | IIRDTKBZINWQAW-UHFFFAOYSA-N |
| Molecular Formula | C12H26O7 |
2-Methyl-2-hexanol 96.0+%, TCI America™
CAS: 625-23-0 Molecular Formula: C7H16O Molecular Weight (g/mol): 116.204 MDL Number: MFCD00004486 InChI Key: KRIMXCDMVRMCTC-UHFFFAOYSA-N Synonym: 2-methyl-2-hexanol,butyldimethylcarbinol,2-hexanol, 2-methyl,tert-heptyl alcohol,1,1-dimethyl-1-pentanol,tert-heptanol 9ci,methyl-2 hexanol-2,2-methyl-2-hexanoi,1-pentanol, dimethyl,2-methyl-2-hydroxyhexane PubChem CID: 12240 IUPAC Name: 2-methylhexan-2-ol SMILES: CCCCC(C)(C)O
| PubChem CID | 12240 |
|---|---|
| CAS | 625-23-0 |
| Molecular Weight (g/mol) | 116.204 |
| MDL Number | MFCD00004486 |
| SMILES | CCCCC(C)(C)O |
| Synonym | 2-methyl-2-hexanol,butyldimethylcarbinol,2-hexanol, 2-methyl,tert-heptyl alcohol,1,1-dimethyl-1-pentanol,tert-heptanol 9ci,methyl-2 hexanol-2,2-methyl-2-hexanoi,1-pentanol, dimethyl,2-methyl-2-hydroxyhexane |
| IUPAC Name | 2-methylhexan-2-ol |
| InChI Key | KRIMXCDMVRMCTC-UHFFFAOYSA-N |
| Molecular Formula | C7H16O |
1,3-Butanediol 99.0+%, TCI America™
CAS: 107-88-0 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00004554 InChI Key: PUPZLCDOIYMWBV-UHFFFAOYSA-N Synonym: 1,3-butanediol,1,3-butylene glycol,1,3-dihydroxybutane,methyltrimethylene glycol,1,3-butandiol,1-methyl-1,3-propanediol,beta-butylene glycol,1,3 butylene glycol,1,3-butylenglykol,rs-1,3-butandiol PubChem CID: 7896 ChEBI: CHEBI:52683 IUPAC Name: butane-1,3-diol SMILES: CC(CCO)O
| PubChem CID | 7896 |
|---|---|
| CAS | 107-88-0 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:52683 |
| MDL Number | MFCD00004554 |
| SMILES | CC(CCO)O |
| Synonym | 1,3-butanediol,1,3-butylene glycol,1,3-dihydroxybutane,methyltrimethylene glycol,1,3-butandiol,1-methyl-1,3-propanediol,beta-butylene glycol,1,3 butylene glycol,1,3-butylenglykol,rs-1,3-butandiol |
| IUPAC Name | butane-1,3-diol |
| InChI Key | PUPZLCDOIYMWBV-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
1,11-Diamino-3,6,9-trioxaundecane 97.0+%, TCI America™
CAS: 929-75-9 Molecular Formula: C8H20N2O3 Molecular Weight (g/mol): 192.26 MDL Number: MFCD00628164 InChI Key: NIQFAJBKEHPUAM-UHFFFAOYSA-N Synonym: Bis[2-(2-aminoethoxy)ethyl] Ether, 3,6,9-Trioxaundecane-1,11-diamine PubChem CID: 70250 IUPAC Name: 2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethan-1-amine SMILES: NCCOCCOCCOCCN
| PubChem CID | 70250 |
|---|---|
| CAS | 929-75-9 |
| Molecular Weight (g/mol) | 192.26 |
| MDL Number | MFCD00628164 |
| SMILES | NCCOCCOCCOCCN |
| Synonym | Bis[2-(2-aminoethoxy)ethyl] Ether, 3,6,9-Trioxaundecane-1,11-diamine |
| IUPAC Name | 2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethan-1-amine |
| InChI Key | NIQFAJBKEHPUAM-UHFFFAOYSA-N |
| Molecular Formula | C8H20N2O3 |
3,4-Dibenzyloxybenzaldehyde 98.0+%, TCI America™
CAS: 5447-02-9 Molecular Formula: C21H18O3 Molecular Weight (g/mol): 318.37 MDL Number: MFCD00004776 InChI Key: XDDLXZHBWVFPRG-UHFFFAOYSA-N Synonym: 3,4-Bis(benzyloxy)benzaldehyde PubChem CID: 79526 IUPAC Name: 3,4-bis(phenylmethoxy)benzaldehyde SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3
| PubChem CID | 79526 |
|---|---|
| CAS | 5447-02-9 |
| Molecular Weight (g/mol) | 318.37 |
| MDL Number | MFCD00004776 |
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3 |
| Synonym | 3,4-Bis(benzyloxy)benzaldehyde |
| IUPAC Name | 3,4-bis(phenylmethoxy)benzaldehyde |
| InChI Key | XDDLXZHBWVFPRG-UHFFFAOYSA-N |
| Molecular Formula | C21H18O3 |
Cyclopentanol 99.0+%, TCI America™
CAS: 96-41-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.134 MDL Number: MFCD00001363 InChI Key: XCIXKGXIYUWCLL-UHFFFAOYSA-N Synonym: hydroxycyclopentane,cyclopentyl alcohol,1-cyclopentanol,unii-1l43q07tbu,dsstox_cid_13371,dsstox_rid_79066,dsstox_gsid_33371,cydopentanol,1-hydroxycyclopentyl,1-cyclopentyl alcohol PubChem CID: 7298 ChEBI: CHEBI:16133 IUPAC Name: cyclopentanol SMILES: C1CCC(C1)O
| PubChem CID | 7298 |
|---|---|
| CAS | 96-41-3 |
| Molecular Weight (g/mol) | 86.134 |
| ChEBI | CHEBI:16133 |
| MDL Number | MFCD00001363 |
| SMILES | C1CCC(C1)O |
| Synonym | hydroxycyclopentane,cyclopentyl alcohol,1-cyclopentanol,unii-1l43q07tbu,dsstox_cid_13371,dsstox_rid_79066,dsstox_gsid_33371,cydopentanol,1-hydroxycyclopentyl,1-cyclopentyl alcohol |
| IUPAC Name | cyclopentanol |
| InChI Key | XCIXKGXIYUWCLL-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
(3-Acetylphenoxy)acetic Acid 98.0+%, TCI America™
CAS: 1878-80-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD02180947 InChI Key: VDZJGFDUSYCVJA-UHFFFAOYSA-N PubChem CID: 241887 IUPAC Name: 2-(3-acetylphenoxy)acetic acid SMILES: CC(=O)C1=CC=CC(OCC(O)=O)=C1
| PubChem CID | 241887 |
|---|---|
| CAS | 1878-80-4 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD02180947 |
| SMILES | CC(=O)C1=CC=CC(OCC(O)=O)=C1 |
| IUPAC Name | 2-(3-acetylphenoxy)acetic acid |
| InChI Key | VDZJGFDUSYCVJA-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
2-Hydroxyisobutyramide 98.0+%, TCI America™
CAS: 13027-88-8 Molecular Formula: C4H9NO2 Molecular Weight (g/mol): 103.121 MDL Number: MFCD08063365 InChI Key: DRYMMXUBDRJPDS-UHFFFAOYSA-N Synonym: 2-Hydroxy-2-methylpropionamide PubChem CID: 83059 IUPAC Name: 2-hydroxy-2-methylpropanamide SMILES: CC(C)(C(=O)N)O
| PubChem CID | 83059 |
|---|---|
| CAS | 13027-88-8 |
| Molecular Weight (g/mol) | 103.121 |
| MDL Number | MFCD08063365 |
| SMILES | CC(C)(C(=O)N)O |
| Synonym | 2-Hydroxy-2-methylpropionamide |
| IUPAC Name | 2-hydroxy-2-methylpropanamide |
| InChI Key | DRYMMXUBDRJPDS-UHFFFAOYSA-N |
| Molecular Formula | C4H9NO2 |
D-Pinitol 98.0+%, TCI America™
CAS: 10284-63-6 Molecular Formula: C7H14O6 Molecular Weight (g/mol): 194.18 MDL Number: MFCD00216659 InChI Key: DSCFFEYYQKSRSV-FEPQRWDDSA-N Synonym: d-pinitol,pinitol,3-o-methyl-d-chiro-inositol,d-+-pinitol,inzitol,pinit,+-pinitol,methylinositol,sennitol,d-ononitol PubChem CID: 164619 IUPAC Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol SMILES: COC1[C@@H](O)[C@@H](O)C(O)[C@H](O)[C@H]1O
| PubChem CID | 164619 |
|---|---|
| CAS | 10284-63-6 |
| Molecular Weight (g/mol) | 194.18 |
| MDL Number | MFCD00216659 |
| SMILES | COC1[C@@H](O)[C@@H](O)C(O)[C@H](O)[C@H]1O |
| Synonym | d-pinitol,pinitol,3-o-methyl-d-chiro-inositol,d-+-pinitol,inzitol,pinit,+-pinitol,methylinositol,sennitol,d-ononitol |
| IUPAC Name | (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol |
| InChI Key | DSCFFEYYQKSRSV-FEPQRWDDSA-N |
| Molecular Formula | C7H14O6 |
cis-1,2-Cyclohexanediol 98.0+%, TCI America™
CAS: 1792-81-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00064944 InChI Key: PFURGBBHAOXLIO-OLQVQODUSA-N Synonym: cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol PubChem CID: 92903 ChEBI: CHEBI:32329 IUPAC Name: (1R,2S)-cyclohexane-1,2-diol SMILES: C1CCC(C(C1)O)O
| PubChem CID | 92903 |
|---|---|
| CAS | 1792-81-0 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:32329 |
| MDL Number | MFCD00064944 |
| SMILES | C1CCC(C(C1)O)O |
| Synonym | cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol |
| IUPAC Name | (1R,2S)-cyclohexane-1,2-diol |
| InChI Key | PFURGBBHAOXLIO-OLQVQODUSA-N |
| Molecular Formula | C6H12O2 |
(-)-2,3-O-Isopropylidene-D-threitol 98.0+%, TCI America™
CAS: 73346-74-4 Molecular Formula: C7H14O4 Molecular Weight (g/mol): 162.185 MDL Number: MFCD00009761 InChI Key: INVRLGIKFANLFP-PHDIDXHHSA-N Synonym: --2,3-o-isopropylidene-d-threitol,2,3-o-isopropylidene-d-threitol,4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,2-3-o-isopropylidene-d-threitol,4r,5r---2,2-dimethyl-1,3-dioxolane-4,5-dimethanol,trans-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,4r,5r-5-hydroxymethyl-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r,5r-4,5-bis hydroxymethyl-2,2-dimethyl-1,3-dioxolane,pubchem6768 PubChem CID: 785244 IUPAC Name: [(4R,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol SMILES: CC1(OC(C(O1)CO)CO)C
| PubChem CID | 785244 |
|---|---|
| CAS | 73346-74-4 |
| Molecular Weight (g/mol) | 162.185 |
| MDL Number | MFCD00009761 |
| SMILES | CC1(OC(C(O1)CO)CO)C |
| Synonym | --2,3-o-isopropylidene-d-threitol,2,3-o-isopropylidene-d-threitol,4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,2-3-o-isopropylidene-d-threitol,4r,5r---2,2-dimethyl-1,3-dioxolane-4,5-dimethanol,trans-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,4r,5r-5-hydroxymethyl-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r,5r-4,5-bis hydroxymethyl-2,2-dimethyl-1,3-dioxolane,pubchem6768 |
| IUPAC Name | [(4R,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol |
| InChI Key | INVRLGIKFANLFP-PHDIDXHHSA-N |
| Molecular Formula | C7H14O4 |
3-Bromo-1-propanol 93.0+%, TCI America™
CAS: 627-18-9 Molecular Formula: C3H7BrO Molecular Weight (g/mol): 138.99 MDL Number: MFCD00002942 InChI Key: RQFUZUMFPRMVDX-UHFFFAOYSA-N Synonym: 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh PubChem CID: 12308 IUPAC Name: 3-bromopropan-1-ol SMILES: OCCCBr
| PubChem CID | 12308 |
|---|---|
| CAS | 627-18-9 |
| Molecular Weight (g/mol) | 138.99 |
| MDL Number | MFCD00002942 |
| SMILES | OCCCBr |
| Synonym | 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh |
| IUPAC Name | 3-bromopropan-1-ol |
| InChI Key | RQFUZUMFPRMVDX-UHFFFAOYSA-N |
| Molecular Formula | C3H7BrO |