Organooxygen compounds
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D-(+)-Melibiose Monohydrate 99.0+%, TCI America™
CAS: 66009-10-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00198188 InChI Key: CHIDEFLSUMQFBY-UHFFFAOYNA-N Synonym: d +-melibiose monohydrate,d-+-melibiose hydrate,585-99-9 anhydrous,melibiose hplc,6-,a-d-galactopyranosyl-d-glucopyranose,6-o-a-d-galactopyranosyl-d-glucopyranose hydrate,6-o-a-d-galactopyranosyl-d-glucose monohydrate,6-o-a-d-galactopyranosyl-d-glucopyranose monohydrate,6-o-alpha-d-galactopyranosyl-d-glucose monohydrate,d-glucose, 6-o-a-d-galactopyranosyl-, monohydrate 9ci PubChem CID: 71308738 IUPAC Name: 2,3,4,5-tetrahydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate SMILES: O.OCC1OC(OCC(O)C(O)C(O)C(O)C=O)C(O)C(O)C1O
| PubChem CID | 71308738 |
|---|---|
| CAS | 66009-10-7 |
| Molecular Weight (g/mol) | 360.31 |
| MDL Number | MFCD00198188 |
| SMILES | O.OCC1OC(OCC(O)C(O)C(O)C(O)C=O)C(O)C(O)C1O |
| Synonym | d +-melibiose monohydrate,d-+-melibiose hydrate,585-99-9 anhydrous,melibiose hplc,6-,a-d-galactopyranosyl-d-glucopyranose,6-o-a-d-galactopyranosyl-d-glucopyranose hydrate,6-o-a-d-galactopyranosyl-d-glucose monohydrate,6-o-a-d-galactopyranosyl-d-glucopyranose monohydrate,6-o-alpha-d-galactopyranosyl-d-glucose monohydrate,d-glucose, 6-o-a-d-galactopyranosyl-, monohydrate 9ci |
| IUPAC Name | 2,3,4,5-tetrahydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate |
| InChI Key | CHIDEFLSUMQFBY-UHFFFAOYNA-N |
| Molecular Formula | C12H24O12 |
Methoxyacetonitrile 98.0+%, TCI America™
CAS: 1738-36-9 Molecular Formula: C3H5NO Molecular Weight (g/mol): 71.08 MDL Number: MFCD00001892 InChI Key: QKPVEISEHYYHRH-UHFFFAOYSA-N PubChem CID: 74442 IUPAC Name: 2-methoxyacetonitrile SMILES: COCC#N
| PubChem CID | 74442 |
|---|---|
| CAS | 1738-36-9 |
| Molecular Weight (g/mol) | 71.08 |
| MDL Number | MFCD00001892 |
| SMILES | COCC#N |
| IUPAC Name | 2-methoxyacetonitrile |
| InChI Key | QKPVEISEHYYHRH-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO |
2,6-Dibromoquinone-4-chloroimide 98.0+%, TCI America™
CAS: 537-45-1 Molecular Formula: C6H2Br2ClNO Molecular Weight (g/mol): 299.346 MDL Number: MFCD00013792 InChI Key: JYWKEVKEKOTYEX-UHFFFAOYSA-N Synonym: 2,6-dibromoquinone-4-chloroimide,2,6-dibromo-4-chloroimino cyclohexa-2,5-dienone,bqc reagent,2,6-dibromoquinone-4-chlorimide,2,6-dibromoquinone chlorimide,2,6-dibromoquinone chloroimide,2,6-dibromoquinone chloroimine,n-chloro-2,6-dibromoquinoneimine,2,5-cyclohexadien-1-one, 2,6-dibromo-4-chloroimino,2,6-dibromo-p-benzoquinone-4-chlorimine PubChem CID: 10835 IUPAC Name: 2,6-dibromo-4-chloroiminocyclohexa-2,5-dien-1-one SMILES: C1=C(C(=O)C(=CC1=NCl)Br)Br
| PubChem CID | 10835 |
|---|---|
| CAS | 537-45-1 |
| Molecular Weight (g/mol) | 299.346 |
| MDL Number | MFCD00013792 |
| SMILES | C1=C(C(=O)C(=CC1=NCl)Br)Br |
| Synonym | 2,6-dibromoquinone-4-chloroimide,2,6-dibromo-4-chloroimino cyclohexa-2,5-dienone,bqc reagent,2,6-dibromoquinone-4-chlorimide,2,6-dibromoquinone chlorimide,2,6-dibromoquinone chloroimide,2,6-dibromoquinone chloroimine,n-chloro-2,6-dibromoquinoneimine,2,5-cyclohexadien-1-one, 2,6-dibromo-4-chloroimino,2,6-dibromo-p-benzoquinone-4-chlorimine |
| IUPAC Name | 2,6-dibromo-4-chloroiminocyclohexa-2,5-dien-1-one |
| InChI Key | JYWKEVKEKOTYEX-UHFFFAOYSA-N |
| Molecular Formula | C6H2Br2ClNO |
Alizarin 95.0+%, TCI America™
CAS: 72-48-0 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001201 InChI Key: RGCKGOZRHPZPFP-UHFFFAOYSA-N Synonym: alizarin,alizarin red,mordant red 11,1,2-dihydroxyanthraquinone,alizarin b,turkey red,1,2-anthraquinonediol,alizarine,alizarina,alizarine red PubChem CID: 6293 ChEBI: CHEBI:16866 IUPAC Name: 1,2-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O
| PubChem CID | 6293 |
|---|---|
| CAS | 72-48-0 |
| Molecular Weight (g/mol) | 240.214 |
| ChEBI | CHEBI:16866 |
| MDL Number | MFCD00001201 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O |
| Synonym | alizarin,alizarin red,mordant red 11,1,2-dihydroxyanthraquinone,alizarin b,turkey red,1,2-anthraquinonediol,alizarine,alizarina,alizarine red |
| IUPAC Name | 1,2-dihydroxyanthracene-9,10-dione |
| InChI Key | RGCKGOZRHPZPFP-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
Chrysazin 98.0+%, TCI America™
CAS: 117-10-2 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001211 InChI Key: QBPFLULOKWLNNW-UHFFFAOYSA-N Synonym: danthron,1,8-dihydroxyanthraquinone,chrysazin,dantron,antrapurol,laxanthreen,diaquone,istizin,laxanorm,altan PubChem CID: 2950 ChEBI: CHEBI:3682 IUPAC Name: 1,8-dihydroxyanthracene-9,10-dione SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O
| PubChem CID | 2950 |
|---|---|
| CAS | 117-10-2 |
| Molecular Weight (g/mol) | 240.214 |
| ChEBI | CHEBI:3682 |
| MDL Number | MFCD00001211 |
| SMILES | C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O |
| Synonym | danthron,1,8-dihydroxyanthraquinone,chrysazin,dantron,antrapurol,laxanthreen,diaquone,istizin,laxanorm,altan |
| IUPAC Name | 1,8-dihydroxyanthracene-9,10-dione |
| InChI Key | QBPFLULOKWLNNW-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
Ethyl 3-Oxohexanoate 95.0+%, TCI America™
CAS: 3249-68-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00009401 InChI Key: KQWWVLVLVYYYDT-UHFFFAOYSA-N Synonym: ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 PubChem CID: 238498 ChEBI: CHEBI:18119 IUPAC Name: ethyl 3-oxohexanoate SMILES: CCCC(=O)CC(=O)OCC
| PubChem CID | 238498 |
|---|---|
| CAS | 3249-68-1 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:18119 |
| MDL Number | MFCD00009401 |
| SMILES | CCCC(=O)CC(=O)OCC |
| Synonym | ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 |
| IUPAC Name | ethyl 3-oxohexanoate |
| InChI Key | KQWWVLVLVYYYDT-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
1-Bromo-2-methoxymethylnaphthalene 98.0+%, TCI America™
CAS: 64689-70-9 Molecular Formula: C12H11BrO Molecular Weight (g/mol): 251.123 MDL Number: MFCD00059518 InChI Key: ORYVAZPUJFACFR-UHFFFAOYSA-N PubChem CID: 12385765 IUPAC Name: 1-bromo-2-(methoxymethyl)naphthalene SMILES: COCC1=C(C2=CC=CC=C2C=C1)Br
| PubChem CID | 12385765 |
|---|---|
| CAS | 64689-70-9 |
| Molecular Weight (g/mol) | 251.123 |
| MDL Number | MFCD00059518 |
| SMILES | COCC1=C(C2=CC=CC=C2C=C1)Br |
| IUPAC Name | 1-bromo-2-(methoxymethyl)naphthalene |
| InChI Key | ORYVAZPUJFACFR-UHFFFAOYSA-N |
| Molecular Formula | C12H11BrO |
5-Bromovanillin 95.0+%, TCI America™
CAS: 2973-76-4 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD00006940 InChI Key: KLSHZDPXXKAHIJ-UHFFFAOYSA-N Synonym: 5-bromovanillin,benzaldehyde, 3-bromo-4-hydroxy-5-methoxy,vanillin, 5-bromo,5-bromo-4-hydroxy-3-methoxybenzaldehyde,3-bromo-4-hydroxy-5-methoxy-benzaldehyde,unii-508wvs56pw,3-bromo-4-hydroxy-5-methyloxy benzaldehyde,5-bromovaniline,5-bromovanilline PubChem CID: 18099 IUPAC Name: 3-bromo-4-hydroxy-5-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(Br)=C1O
| PubChem CID | 18099 |
|---|---|
| CAS | 2973-76-4 |
| Molecular Weight (g/mol) | 231.05 |
| MDL Number | MFCD00006940 |
| SMILES | COC1=CC(C=O)=CC(Br)=C1O |
| Synonym | 5-bromovanillin,benzaldehyde, 3-bromo-4-hydroxy-5-methoxy,vanillin, 5-bromo,5-bromo-4-hydroxy-3-methoxybenzaldehyde,3-bromo-4-hydroxy-5-methoxy-benzaldehyde,unii-508wvs56pw,3-bromo-4-hydroxy-5-methyloxy benzaldehyde,5-bromovaniline,5-bromovanilline |
| IUPAC Name | 3-bromo-4-hydroxy-5-methoxybenzaldehyde |
| InChI Key | KLSHZDPXXKAHIJ-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO3 |
2-Bromoethyl Ethyl Ether 95.0+%, TCI America™
CAS: 592-55-2 Molecular Formula: C4H9BrO Molecular Weight (g/mol): 153.02 MDL Number: MFCD00000237 InChI Key: MMYKTRPLXXWLBC-UHFFFAOYSA-N Synonym: 2-bromoethyl ethyl ether,2-ethoxyethyl bromide,2-bromoethoxyethane,ethane, 1-bromo-2-ethoxy,2-bromodiethyl ether,1-ethoxy-2-bromoethane,1-bromo-2-ethoxy-ethane,ether, 2-bromoethyl ethyl,2-bromoethylethylether,1-bromo-3-oxapentane PubChem CID: 61141 IUPAC Name: 1-bromo-2-ethoxyethane SMILES: CCOCCBr
| PubChem CID | 61141 |
|---|---|
| CAS | 592-55-2 |
| Molecular Weight (g/mol) | 153.02 |
| MDL Number | MFCD00000237 |
| SMILES | CCOCCBr |
| Synonym | 2-bromoethyl ethyl ether,2-ethoxyethyl bromide,2-bromoethoxyethane,ethane, 1-bromo-2-ethoxy,2-bromodiethyl ether,1-ethoxy-2-bromoethane,1-bromo-2-ethoxy-ethane,ether, 2-bromoethyl ethyl,2-bromoethylethylether,1-bromo-3-oxapentane |
| IUPAC Name | 1-bromo-2-ethoxyethane |
| InChI Key | MMYKTRPLXXWLBC-UHFFFAOYSA-N |
| Molecular Formula | C4H9BrO |
5-Benzyloxyindole 98.0+%, TCI America™
CAS: 1215-59-4 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.275 MDL Number: MFCD00005676 InChI Key: JCQLPDZCNSVBMS-UHFFFAOYSA-N Synonym: 5-benzyloxyindole,5-benzyloxy-1h-indole,1h-indole, 5-phenylmethoxy,benzyloxy-5 indole,indole, 5-benzyloxy,5-benzyloxy indole,unii-yci4z02e1c PubChem CID: 14624 IUPAC Name: 5-phenylmethoxy-1H-indole SMILES: C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3
| PubChem CID | 14624 |
|---|---|
| CAS | 1215-59-4 |
| Molecular Weight (g/mol) | 223.275 |
| MDL Number | MFCD00005676 |
| SMILES | C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3 |
| Synonym | 5-benzyloxyindole,5-benzyloxy-1h-indole,1h-indole, 5-phenylmethoxy,benzyloxy-5 indole,indole, 5-benzyloxy,5-benzyloxy indole,unii-yci4z02e1c |
| IUPAC Name | 5-phenylmethoxy-1H-indole |
| InChI Key | JCQLPDZCNSVBMS-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
2-(Bromoacetyl)-6-methoxynaphthalene 98.0+%, TCI America™
CAS: 10262-65-4 Molecular Formula: C13H11BrO2 Molecular Weight (g/mol): 279.133 MDL Number: MFCD03964189 InChI Key: HHHKEQGAGUAOQI-UHFFFAOYSA-N Synonym: 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone PubChem CID: 193452 IUPAC Name: 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone SMILES: COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr
| PubChem CID | 193452 |
|---|---|
| CAS | 10262-65-4 |
| Molecular Weight (g/mol) | 279.133 |
| MDL Number | MFCD03964189 |
| SMILES | COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr |
| Synonym | 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone |
| IUPAC Name | 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone |
| InChI Key | HHHKEQGAGUAOQI-UHFFFAOYSA-N |
| Molecular Formula | C13H11BrO2 |
2-(3-Bromopropyl)-1,3-dioxolane 97.0+%, TCI America™
CAS: 62563-07-9 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.056 InChI Key: IQIXIJRPYSOGPY-UHFFFAOYSA-N Synonym: 4-Bromobutyraldehyde Ethylene Acetal PubChem CID: 357783 IUPAC Name: 2-(3-bromopropyl)-1,3-dioxolane SMILES: C1COC(O1)CCCBr
| PubChem CID | 357783 |
|---|---|
| CAS | 62563-07-9 |
| Molecular Weight (g/mol) | 195.056 |
| SMILES | C1COC(O1)CCCBr |
| Synonym | 4-Bromobutyraldehyde Ethylene Acetal |
| IUPAC Name | 2-(3-bromopropyl)-1,3-dioxolane |
| InChI Key | IQIXIJRPYSOGPY-UHFFFAOYSA-N |
| Molecular Formula | C6H11BrO2 |
Valerophenone 98.0+%, TCI America™
CAS: 1009-14-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00009480 InChI Key: XKGLSKVNOSHTAD-UHFFFAOYSA-N Synonym: valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci PubChem CID: 66093 ChEBI: CHEBI:36812 IUPAC Name: 1-phenylpentan-1-one SMILES: CCCCC(=O)C1=CC=CC=C1
| PubChem CID | 66093 |
|---|---|
| CAS | 1009-14-9 |
| Molecular Weight (g/mol) | 162.23 |
| ChEBI | CHEBI:36812 |
| MDL Number | MFCD00009480 |
| SMILES | CCCCC(=O)C1=CC=CC=C1 |
| Synonym | valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci |
| IUPAC Name | 1-phenylpentan-1-one |
| InChI Key | XKGLSKVNOSHTAD-UHFFFAOYSA-N |
| Molecular Formula | C11H14O |
trans,trans-2,4-Heptadienal 90.0+%, TCI America™
CAS: 4313-03-5 Molecular Formula: C7H10O Molecular Weight (g/mol): 110.16 MDL Number: MFCD00007005 InChI Key: SATICYYAWWYRAM-VNKDHWASSA-N PubChem CID: 5283321 IUPAC Name: (2E,4E)-hepta-2,4-dienal SMILES: CCC=CC=CC=O
| PubChem CID | 5283321 |
|---|---|
| CAS | 4313-03-5 |
| Molecular Weight (g/mol) | 110.16 |
| MDL Number | MFCD00007005 |
| SMILES | CCC=CC=CC=O |
| IUPAC Name | (2E,4E)-hepta-2,4-dienal |
| InChI Key | SATICYYAWWYRAM-VNKDHWASSA-N |
| Molecular Formula | C7H10O |
2-Bromo-4'-methylpropiophenone 98.0+%, TCI America™
CAS: 1451-82-7 Molecular Formula: C10H11BrO Molecular Weight (g/mol): 227.10 MDL Number: MFCD11131402 InChI Key: OZLUPIIIHOOPNQ-UHFFFAOYNA-N Synonym: 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone PubChem CID: 2734063 IUPAC Name: 2-bromo-1-(4-methylphenyl)propan-1-one SMILES: CC(Br)C(=O)C1=CC=C(C)C=C1
| PubChem CID | 2734063 |
|---|---|
| CAS | 1451-82-7 |
| Molecular Weight (g/mol) | 227.10 |
| MDL Number | MFCD11131402 |
| SMILES | CC(Br)C(=O)C1=CC=C(C)C=C1 |
| Synonym | 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone |
| IUPAC Name | 2-bromo-1-(4-methylphenyl)propan-1-one |
| InChI Key | OZLUPIIIHOOPNQ-UHFFFAOYNA-N |
| Molecular Formula | C10H11BrO |