Organooxygen compounds
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3'-Chloro-4'-hydroxyacetophenone 98.0+%, TCI America™
CAS: 2892-29-7 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00663621 InChI Key: GMTSPBYBJKGPJF-UHFFFAOYSA-N Synonym: 4-Acetyl-2-chlorophenol PubChem CID: 1051514 IUPAC Name: 1-(3-chloro-4-hydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(O)C(Cl)=C1
| PubChem CID | 1051514 |
|---|---|
| CAS | 2892-29-7 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00663621 |
| SMILES | CC(=O)C1=CC=C(O)C(Cl)=C1 |
| Synonym | 4-Acetyl-2-chlorophenol |
| IUPAC Name | 1-(3-chloro-4-hydroxyphenyl)ethan-1-one |
| InChI Key | GMTSPBYBJKGPJF-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
3,4-O-Isopropylidene-D-mannitol 96.0+%, TCI America™
CAS: 3969-84-4 Molecular Formula: C9H18O6 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00075122 InChI Key: YCOMFYACDCWMMD-UHFFFAOYNA-N Synonym: 3,4-o-isopropylidene-d-mannitol,1r,1'r-1,1'-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl bis ethane-1,2-diol,1r-1-4r,5r-5-1r-1,2-dihydroxyethyl-2,2-dimethyl-1,3-dioxolan-4-yl ethane-1,2-diol,oi4-o-isopropylidene-d-mannitol,d-mannitol-3,4-acetonide,3-o,4-o-isopropylidene-d-mannitol,3,4-isopropylidene-d-mannitol,3,4-o-1-methylethylidene-d-mannitol,1r,1'r-1,1'-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl diethane-1,2-diol PubChem CID: 7096260 IUPAC Name: 1-[5-(1,2-dihydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol SMILES: CC1(C)OC(C(O)CO)C(O1)C(O)CO
| PubChem CID | 7096260 |
|---|---|
| CAS | 3969-84-4 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00075122 |
| SMILES | CC1(C)OC(C(O)CO)C(O1)C(O)CO |
| Synonym | 3,4-o-isopropylidene-d-mannitol,1r,1'r-1,1'-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl bis ethane-1,2-diol,1r-1-4r,5r-5-1r-1,2-dihydroxyethyl-2,2-dimethyl-1,3-dioxolan-4-yl ethane-1,2-diol,oi4-o-isopropylidene-d-mannitol,d-mannitol-3,4-acetonide,3-o,4-o-isopropylidene-d-mannitol,3,4-isopropylidene-d-mannitol,3,4-o-1-methylethylidene-d-mannitol,1r,1'r-1,1'-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl diethane-1,2-diol |
| IUPAC Name | 1-[5-(1,2-dihydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol |
| InChI Key | YCOMFYACDCWMMD-UHFFFAOYNA-N |
| Molecular Formula | C9H18O6 |
5-Allyl-3-methoxysalicylaldehyde 98.0+%, TCI America™
CAS: 22934-51-6 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD06408022 InChI Key: FDHXEIOBIOVBEN-UHFFFAOYSA-N Synonym: 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde PubChem CID: 1713887 IUPAC Name: 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyde SMILES: COC1=C(C(=CC(=C1)CC=C)C=O)O
| PubChem CID | 1713887 |
|---|---|
| CAS | 22934-51-6 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD06408022 |
| SMILES | COC1=C(C(=CC(=C1)CC=C)C=O)O |
| Synonym | 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde |
| IUPAC Name | 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyde |
| InChI Key | FDHXEIOBIOVBEN-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
8-Chloro-1-n-octanol 97.0+%, TCI America™
CAS: 23144-52-7 Molecular Formula: C8H17ClO Molecular Weight (g/mol): 164.673 MDL Number: MFCD00040005 InChI Key: YDFAJMDFCCJZSI-UHFFFAOYSA-N Synonym: 8-chloro-1-octanol,1-octanol, 8-chloro,8-chlorooctanol,8-chloro-octan-1-ol,8-chloro-1-n-octanol,8-chlor-1-octanol,8-chlor-octan-1-ol,acmc-1cr4x PubChem CID: 90012 IUPAC Name: 8-chlorooctan-1-ol SMILES: C(CCCCCl)CCCO
| PubChem CID | 90012 |
|---|---|
| CAS | 23144-52-7 |
| Molecular Weight (g/mol) | 164.673 |
| MDL Number | MFCD00040005 |
| SMILES | C(CCCCCl)CCCO |
| Synonym | 8-chloro-1-octanol,1-octanol, 8-chloro,8-chlorooctanol,8-chloro-octan-1-ol,8-chloro-1-n-octanol,8-chlor-1-octanol,8-chlor-octan-1-ol,acmc-1cr4x |
| IUPAC Name | 8-chlorooctan-1-ol |
| InChI Key | YDFAJMDFCCJZSI-UHFFFAOYSA-N |
| Molecular Formula | C8H17ClO |
4-Methyl-2-phenyl-1,3-dioxolane (mixture of isomers) 98.0+%, TCI America™
CAS: 2568-25-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00059732 InChI Key: CDIKGISJRLTLRA-UHFFFAOYSA-N Synonym: benzaldehyde propylene glycol acetal,1,3-dioxolane, 4-methyl-2-phenyl,4-methyl-2-phenyl-m-dioxolane,benzaldehyde propylene glycolacetal,benzaldehyde propyleneglycol acetal,benzaldehyde propylene acetal,4-methyl-2-phenyl-1.3-dioxolane,4-methyl-2-phenyl-1,3 dioxolane,#,benzaldehydepropyleneglycolacetal PubChem CID: 595928 IUPAC Name: 4-methyl-2-phenyl-1,3-dioxolane SMILES: CC1COC(O1)C2=CC=CC=C2
| PubChem CID | 595928 |
|---|---|
| CAS | 2568-25-4 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00059732 |
| SMILES | CC1COC(O1)C2=CC=CC=C2 |
| Synonym | benzaldehyde propylene glycol acetal,1,3-dioxolane, 4-methyl-2-phenyl,4-methyl-2-phenyl-m-dioxolane,benzaldehyde propylene glycolacetal,benzaldehyde propyleneglycol acetal,benzaldehyde propylene acetal,4-methyl-2-phenyl-1.3-dioxolane,4-methyl-2-phenyl-1,3 dioxolane,#,benzaldehydepropyleneglycolacetal |
| IUPAC Name | 4-methyl-2-phenyl-1,3-dioxolane |
| InChI Key | CDIKGISJRLTLRA-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
2-Ethoxypyridine 98.0+%, TCI America™
CAS: 14529-53-4 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00023464 InChI Key: LISKAOIANGDBTB-UHFFFAOYSA-N Synonym: pyridine, 2-ethoxy,2-ethoxy pyridine,2-ethoxy-pyridine,zlchem 304,pubchem1126,acmc-209cun,ethyl 2-pyridinyl ether,ksc497c7d PubChem CID: 84499 IUPAC Name: 2-ethoxypyridine SMILES: CCOC1=CC=CC=N1
| PubChem CID | 84499 |
|---|---|
| CAS | 14529-53-4 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00023464 |
| SMILES | CCOC1=CC=CC=N1 |
| Synonym | pyridine, 2-ethoxy,2-ethoxy pyridine,2-ethoxy-pyridine,zlchem 304,pubchem1126,acmc-209cun,ethyl 2-pyridinyl ether,ksc497c7d |
| IUPAC Name | 2-ethoxypyridine |
| InChI Key | LISKAOIANGDBTB-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
Diethyl Acetonylmalonate 95.0+%, TCI America™
CAS: 23193-18-2 Molecular Formula: C10H16O5 Molecular Weight (g/mol): 216.233 MDL Number: MFCD00177949 InChI Key: KGZCSZOGMMZHKB-UHFFFAOYSA-N Synonym: Acetonylmalonic Acid Diethyl Ester, Diethyl 2-Oxopropylmalonate, 2-Oxopropylmalonic Acid Diethyl Ester PubChem CID: 12000252 IUPAC Name: diethyl 2-(2-oxopropyl)propanedioate SMILES: CCOC(=O)C(CC(=O)C)C(=O)OCC
| PubChem CID | 12000252 |
|---|---|
| CAS | 23193-18-2 |
| Molecular Weight (g/mol) | 216.233 |
| MDL Number | MFCD00177949 |
| SMILES | CCOC(=O)C(CC(=O)C)C(=O)OCC |
| Synonym | Acetonylmalonic Acid Diethyl Ester, Diethyl 2-Oxopropylmalonate, 2-Oxopropylmalonic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-(2-oxopropyl)propanedioate |
| InChI Key | KGZCSZOGMMZHKB-UHFFFAOYSA-N |
| Molecular Formula | C10H16O5 |
4',6'-Dimethoxy-2'-hydroxyacetophenone 98.0+%, TCI America™
CAS: 90-24-4 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00017243 InChI Key: FBUBVLUPUDBFME-UHFFFAOYSA-N Synonym: xanthoxylin,2'-hydroxy-4',6'-dimethoxyacetophenone,brevifolin,xanthoxyline,2-hydroxy-4,6-dimethoxyacetophenone,1-2-hydroxy-4,6-dimethoxyphenyl ethanone,brevifolin zanthoxylum,phloracetophenone dimethyl ether,brevifolin van,1-2-hydroxy-4,6-dimethoxyphenyl ethan-1-one PubChem CID: 66654 ChEBI: CHEBI:10070 IUPAC Name: 1-(2-hydroxy-4,6-dimethoxyphenyl)ethan-1-one SMILES: COC1=CC(O)=C(C(C)=O)C(OC)=C1
| PubChem CID | 66654 |
|---|---|
| CAS | 90-24-4 |
| Molecular Weight (g/mol) | 196.20 |
| ChEBI | CHEBI:10070 |
| MDL Number | MFCD00017243 |
| SMILES | COC1=CC(O)=C(C(C)=O)C(OC)=C1 |
| Synonym | xanthoxylin,2'-hydroxy-4',6'-dimethoxyacetophenone,brevifolin,xanthoxyline,2-hydroxy-4,6-dimethoxyacetophenone,1-2-hydroxy-4,6-dimethoxyphenyl ethanone,brevifolin zanthoxylum,phloracetophenone dimethyl ether,brevifolin van,1-2-hydroxy-4,6-dimethoxyphenyl ethan-1-one |
| IUPAC Name | 1-(2-hydroxy-4,6-dimethoxyphenyl)ethan-1-one |
| InChI Key | FBUBVLUPUDBFME-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
1-Amino-2-methylanthraquinone 90.0+%, TCI America™
CAS: 82-28-0 Molecular Formula: C15H11NO2 Molecular Weight (g/mol): 237.26 MDL Number: MFCD00001220 InChI Key: ZLCUIOWQYBYEBG-UHFFFAOYSA-N Synonym: Disperse Orange 11 PubChem CID: 6702 ChEBI: CHEBI:82382 IUPAC Name: 1-amino-2-methyl-9,10-dihydroanthracene-9,10-dione SMILES: CC1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1N
| PubChem CID | 6702 |
|---|---|
| CAS | 82-28-0 |
| Molecular Weight (g/mol) | 237.26 |
| ChEBI | CHEBI:82382 |
| MDL Number | MFCD00001220 |
| SMILES | CC1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1N |
| Synonym | Disperse Orange 11 |
| IUPAC Name | 1-amino-2-methyl-9,10-dihydroanthracene-9,10-dione |
| InChI Key | ZLCUIOWQYBYEBG-UHFFFAOYSA-N |
| Molecular Formula | C15H11NO2 |
4-Trifluoroacetyl-3-methyl-1-phenyl-5-pyrazolone 96.0+%, TCI America™
CAS: 1691-93-6 Molecular Formula: C12H9F3N2O2 Molecular Weight (g/mol): 270.211 MDL Number: MFCD00143378 InChI Key: XJJDGTPFEFAAMV-UHFFFAOYSA-N Synonym: 3-Methyl-1-phenyl-4-trifluoroacetyl-5-pyrazolone PubChem CID: 781778 IUPAC Name: 5-methyl-2-phenyl-4-(2,2,2-trifluoroacetyl)-1H-pyrazol-3-one SMILES: CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)C(F)(F)F
| PubChem CID | 781778 |
|---|---|
| CAS | 1691-93-6 |
| Molecular Weight (g/mol) | 270.211 |
| MDL Number | MFCD00143378 |
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)C(F)(F)F |
| Synonym | 3-Methyl-1-phenyl-4-trifluoroacetyl-5-pyrazolone |
| IUPAC Name | 5-methyl-2-phenyl-4-(2,2,2-trifluoroacetyl)-1H-pyrazol-3-one |
| InChI Key | XJJDGTPFEFAAMV-UHFFFAOYSA-N |
| Molecular Formula | C12H9F3N2O2 |
DL-Glyceraldehyde Diethyl Acetal 95.0+%, TCI America™
CAS: 10487-05-5 Molecular Formula: C7H16O4 Molecular Weight (g/mol): 164.201 MDL Number: MFCD00059599 InChI Key: BPNZBKXZVJVEJD-UHFFFAOYSA-N PubChem CID: 542749 IUPAC Name: 3,3-diethoxypropane-1,2-diol SMILES: CCOC(C(CO)O)OCC
| PubChem CID | 542749 |
|---|---|
| CAS | 10487-05-5 |
| Molecular Weight (g/mol) | 164.201 |
| MDL Number | MFCD00059599 |
| SMILES | CCOC(C(CO)O)OCC |
| IUPAC Name | 3,3-diethoxypropane-1,2-diol |
| InChI Key | BPNZBKXZVJVEJD-UHFFFAOYSA-N |
| Molecular Formula | C7H16O4 |
3-Methoxypropionitrile 99.0+%, TCI America™
CAS: 110-67-8 Molecular Formula: C4H7NO Molecular Weight (g/mol): 85.106 MDL Number: MFCD00001958 InChI Key: OOWFYDWAMOKVSF-UHFFFAOYSA-N Synonym: 3-methoxypropionitrile,propanenitrile, 3-methoxy,2-cyanoethyl methyl ether,3-methoxypropylnitrile,beta-methoxypropionitrile,1-cyano-2-methoxyethane,propionitrile, 3-methoxy,3-methoxypropannitril,3-methoxypropiononitrile,beta-methyoxypropionitrile PubChem CID: 61032 IUPAC Name: 3-methoxypropanenitrile SMILES: COCCC#N
| PubChem CID | 61032 |
|---|---|
| CAS | 110-67-8 |
| Molecular Weight (g/mol) | 85.106 |
| MDL Number | MFCD00001958 |
| SMILES | COCCC#N |
| Synonym | 3-methoxypropionitrile,propanenitrile, 3-methoxy,2-cyanoethyl methyl ether,3-methoxypropylnitrile,beta-methoxypropionitrile,1-cyano-2-methoxyethane,propionitrile, 3-methoxy,3-methoxypropannitril,3-methoxypropiononitrile,beta-methyoxypropionitrile |
| IUPAC Name | 3-methoxypropanenitrile |
| InChI Key | OOWFYDWAMOKVSF-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO |
12-Bromo-1-dodecanol 98.0+%, TCI America™
CAS: 3344-77-2 Molecular Formula: C12H25BrO Molecular Weight (g/mol): 265.24 MDL Number: MFCD00004754 InChI Key: ASIDMJNTHJYVQJ-UHFFFAOYSA-N PubChem CID: 137895 IUPAC Name: 12-bromododecan-1-ol SMILES: OCCCCCCCCCCCCBr
| PubChem CID | 137895 |
|---|---|
| CAS | 3344-77-2 |
| Molecular Weight (g/mol) | 265.24 |
| MDL Number | MFCD00004754 |
| SMILES | OCCCCCCCCCCCCBr |
| IUPAC Name | 12-bromododecan-1-ol |
| InChI Key | ASIDMJNTHJYVQJ-UHFFFAOYSA-N |
| Molecular Formula | C12H25BrO |
4-Amino-2-methyl-1-butanol 98.0+%, TCI America™
CAS: 44565-27-7 Molecular Formula: C5H13NO Molecular Weight (g/mol): 103.17 MDL Number: MFCD03093615 InChI Key: DUAXLVGFFDFSAG-UHFFFAOYNA-N PubChem CID: 10129911 IUPAC Name: 4-amino-2-methylbutan-1-ol SMILES: CC(CO)CCN
| PubChem CID | 10129911 |
|---|---|
| CAS | 44565-27-7 |
| Molecular Weight (g/mol) | 103.17 |
| MDL Number | MFCD03093615 |
| SMILES | CC(CO)CCN |
| IUPAC Name | 4-amino-2-methylbutan-1-ol |
| InChI Key | DUAXLVGFFDFSAG-UHFFFAOYNA-N |
| Molecular Formula | C5H13NO |
1,3,5-Cyclohexanetriol (cis- and trans- mixture) 95.0+%, TCI America™
CAS: 2041-15-8 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00043062,MFCD00070580 InChI Key: FSDSKERRNURGGO-UHFFFAOYSA-N PubChem CID: 230351 IUPAC Name: cyclohexane-1,3,5-triol SMILES: OC1CC(O)CC(O)C1
| PubChem CID | 230351 |
|---|---|
| CAS | 2041-15-8 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00043062,MFCD00070580 |
| SMILES | OC1CC(O)CC(O)C1 |
| IUPAC Name | cyclohexane-1,3,5-triol |
| InChI Key | FSDSKERRNURGGO-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |