Organooxygen compounds
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Thiazole-4-carboxaldehyde, 95%
CAS: 3364-80-5 Molecular Formula: C4H3NOS Molecular Weight (g/mol): 113.13 MDL Number: MFCD00626896 InChI Key: WRFKSVINLIQRKF-UHFFFAOYSA-N Synonym: thiazole-4-carboxaldehyde,thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,thiazole-4-carboxyaldehyde,4-formylthiazole,1,3-thiazole-4-carboxaldehyde,4-thiazolecarbaldehyde,zlchem 1299,pubchem13812,4-formyl-1,3-thiazole PubChem CID: 2763214 IUPAC Name: 1,3-thiazole-4-carbaldehyde SMILES: O=CC1=CSC=N1
| PubChem CID | 2763214 |
|---|---|
| CAS | 3364-80-5 |
| Molecular Weight (g/mol) | 113.13 |
| MDL Number | MFCD00626896 |
| SMILES | O=CC1=CSC=N1 |
| Synonym | thiazole-4-carboxaldehyde,thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,thiazole-4-carboxyaldehyde,4-formylthiazole,1,3-thiazole-4-carboxaldehyde,4-thiazolecarbaldehyde,zlchem 1299,pubchem13812,4-formyl-1,3-thiazole |
| IUPAC Name | 1,3-thiazole-4-carbaldehyde |
| InChI Key | WRFKSVINLIQRKF-UHFFFAOYSA-N |
| Molecular Formula | C4H3NOS |
5-Methoxyindole-2-carboxylic acid, 97%
CAS: 4382-54-1 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.19 MDL Number: MFCD00005614 InChI Key: YEBJVSLNUMZXRJ-UHFFFAOYSA-N Synonym: 5-methoxyindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5-methoxy,5-methoxy-2-indolecarboxylic acid,indole-2-carboxylic acid, 5-methoxy,acide methoxy-5 indole carboxylique-2,acide methoxy-5 indole carboxylique-2 french,5-methoxyindol-2-carboxylic acid,5-methoxy-1h-indole-2-carboxylicacid,pubchem1702,acmc-209jvj PubChem CID: 20401 IUPAC Name: 5-methoxy-1H-indole-2-carboxylic acid SMILES: COC1=CC=C2NC(=CC2=C1)C(O)=O
| PubChem CID | 20401 |
|---|---|
| CAS | 4382-54-1 |
| Molecular Weight (g/mol) | 191.19 |
| MDL Number | MFCD00005614 |
| SMILES | COC1=CC=C2NC(=CC2=C1)C(O)=O |
| Synonym | 5-methoxyindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5-methoxy,5-methoxy-2-indolecarboxylic acid,indole-2-carboxylic acid, 5-methoxy,acide methoxy-5 indole carboxylique-2,acide methoxy-5 indole carboxylique-2 french,5-methoxyindol-2-carboxylic acid,5-methoxy-1h-indole-2-carboxylicacid,pubchem1702,acmc-209jvj |
| IUPAC Name | 5-methoxy-1H-indole-2-carboxylic acid |
| InChI Key | YEBJVSLNUMZXRJ-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO3 |
2-Hydroxy-3-methoxybenzaldehyde, 99%
CAS: 148-53-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00003322 InChI Key: JJVNINGBHGBWJH-UHFFFAOYSA-N Synonym: 3-methoxysalicylaldehyde,o-vanillin,6-formylguaiacol,2-vanillin,o-vanilline,benzaldehyde, 2-hydroxy-3-methoxy,orthovanilline,2-hydroxy-m-anisaldehyde,6-formyl-2-methoxyphenol,3-methoxy-2-hydroxybenzaldehyde PubChem CID: 8991 ChEBI: CHEBI:78339 IUPAC Name: 2-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC=CC(C=O)=C1O
| PubChem CID | 8991 |
|---|---|
| CAS | 148-53-8 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:78339 |
| MDL Number | MFCD00003322 |
| SMILES | COC1=CC=CC(C=O)=C1O |
| Synonym | 3-methoxysalicylaldehyde,o-vanillin,6-formylguaiacol,2-vanillin,o-vanilline,benzaldehyde, 2-hydroxy-3-methoxy,orthovanilline,2-hydroxy-m-anisaldehyde,6-formyl-2-methoxyphenol,3-methoxy-2-hydroxybenzaldehyde |
| IUPAC Name | 2-hydroxy-3-methoxybenzaldehyde |
| InChI Key | JJVNINGBHGBWJH-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
1,1,1,3,3,3-Hexafluoroacetone sesquihydrate, 98%
CAS: 13098-39-0 Molecular Formula: 1·5 H2O Molecular Weight (g/mol): 193.05 MDL Number: MFCD06800792 InChI Key: VAIZVCMDJPBJCM-UHFFFAOYSA-N Synonym: hexafluoroacetone sesquihydrate,unii-cu1noz8ps6,ccris 4653,acetone, hexafluoro-, sesquihydrate,hexafluoro-2-propanone sesquihydrate,cu1noz8ps6,2-propanone, hexafluoro-, sesquihydrate,1,1,1,3,3,3-hexafluoroacetone sesquihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, hydrate 2:3,hexafluoroacetone 1.5-hydrate PubChem CID: 3032602 IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate SMILES: C(=O)(C(F)(F)F)C(F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F.O.O.O
| PubChem CID | 3032602 |
|---|---|
| CAS | 13098-39-0 |
| Molecular Weight (g/mol) | 193.05 |
| MDL Number | MFCD06800792 |
| SMILES | C(=O)(C(F)(F)F)C(F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F.O.O.O |
| Synonym | hexafluoroacetone sesquihydrate,unii-cu1noz8ps6,ccris 4653,acetone, hexafluoro-, sesquihydrate,hexafluoro-2-propanone sesquihydrate,cu1noz8ps6,2-propanone, hexafluoro-, sesquihydrate,1,1,1,3,3,3-hexafluoroacetone sesquihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, hydrate 2:3,hexafluoroacetone 1.5-hydrate |
| IUPAC Name | 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate |
| InChI Key | VAIZVCMDJPBJCM-UHFFFAOYSA-N |
| Molecular Formula | 1·5 H2O |
6-Methylindole-3-carboxaldehyde, 98%, Thermo Scientific Chemicals
CAS: 4771-49-7 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00049347 InChI Key: LZERQSJGPXFAKB-UHFFFAOYSA-N Synonym: 6-methylindole-3-carboxaldehyde,6-methylindole-3-carboxyaldehyde,1h-indole-3-carboxaldehyde, 6-methyl,6-methylindole-3-carbaldehyde,6-methyl-1h-indole-3-carboxaldehyde,1h-indole-3-carboxaldehyde,6-methyl,pubchem7241,acmc-209ka7,ksc497o2l,6-methylindole-3-caboxaldehyde PubChem CID: 4777902 IUPAC Name: 6-methyl-1H-indole-3-carbaldehyde SMILES: CC1=CC=C2C(NC=C2C=O)=C1
| PubChem CID | 4777902 |
|---|---|
| CAS | 4771-49-7 |
| Molecular Weight (g/mol) | 159.19 |
| MDL Number | MFCD00049347 |
| SMILES | CC1=CC=C2C(NC=C2C=O)=C1 |
| Synonym | 6-methylindole-3-carboxaldehyde,6-methylindole-3-carboxyaldehyde,1h-indole-3-carboxaldehyde, 6-methyl,6-methylindole-3-carbaldehyde,6-methyl-1h-indole-3-carboxaldehyde,1h-indole-3-carboxaldehyde,6-methyl,pubchem7241,acmc-209ka7,ksc497o2l,6-methylindole-3-caboxaldehyde |
| IUPAC Name | 6-methyl-1H-indole-3-carbaldehyde |
| InChI Key | LZERQSJGPXFAKB-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
(R)-(+)-2-Methoxypropionic acid, 97%
CAS: 23943-96-6 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD01632582 InChI Key: ICPWFHKNYYRBSZ-GSVOUGTGSA-N Synonym: r-2-methoxypropanoic acid,2r-2-methoxypropanoic acid,unii-ig4dib9v6i,r---2-methoxypropionic acid,propanoic acid, 2-methoxy-, r,2-methoxypropanoic acid, r,r-+-2-methoxypropionic acid,ig4dib9v6i,r-+-2-methoxypropanoic acid,propanoic acid, 2-methoxy-, 2r PubChem CID: 2733584 IUPAC Name: (2R)-2-methoxypropanoic acid SMILES: CC(C(=O)O)OC
| PubChem CID | 2733584 |
|---|---|
| CAS | 23943-96-6 |
| Molecular Weight (g/mol) | 104.11 |
| MDL Number | MFCD01632582 |
| SMILES | CC(C(=O)O)OC |
| Synonym | r-2-methoxypropanoic acid,2r-2-methoxypropanoic acid,unii-ig4dib9v6i,r---2-methoxypropionic acid,propanoic acid, 2-methoxy-, r,2-methoxypropanoic acid, r,r-+-2-methoxypropionic acid,ig4dib9v6i,r-+-2-methoxypropanoic acid,propanoic acid, 2-methoxy-, 2r |
| IUPAC Name | (2R)-2-methoxypropanoic acid |
| InChI Key | ICPWFHKNYYRBSZ-GSVOUGTGSA-N |
| Molecular Formula | C4H8O3 |
6-Bromo-1-indanone, 97%
CAS: 14548-39-1 Molecular Formula: C9H7BrO Molecular Weight (g/mol): 211.058 MDL Number: MFCD02179286 InChI Key: SEQHEDQNODAFIU-UHFFFAOYSA-N Synonym: 6-bromo-1-indanone,6-bromoindanone,6-bromo-2,3-dihydro-1h-inden-1-one,6-bromo-indan-1-one,6-bromoindan-1-one,1-indanone, 6-bromo,1h-inden-1-one, 6-bromo-2,3-dihydro,6-bromo indanone,6-bromo-indanone PubChem CID: 139778 IUPAC Name: 6-bromo-2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=C1C=CC(=C2)Br
| PubChem CID | 139778 |
|---|---|
| CAS | 14548-39-1 |
| Molecular Weight (g/mol) | 211.058 |
| MDL Number | MFCD02179286 |
| SMILES | C1CC(=O)C2=C1C=CC(=C2)Br |
| Synonym | 6-bromo-1-indanone,6-bromoindanone,6-bromo-2,3-dihydro-1h-inden-1-one,6-bromo-indan-1-one,6-bromoindan-1-one,1-indanone, 6-bromo,1h-inden-1-one, 6-bromo-2,3-dihydro,6-bromo indanone,6-bromo-indanone |
| IUPAC Name | 6-bromo-2,3-dihydroinden-1-one |
| InChI Key | SEQHEDQNODAFIU-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrO |
2-Bromo-3-pyridinecarboxaldehyde, 96%
CAS: 128071-75-0 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186 MDL Number: MFCD04966945 InChI Key: GNFWMEFWZWXLIN-UHFFFAOYSA-N Synonym: 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde PubChem CID: 4714951 IUPAC Name: 2-bromopyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)Br)C=O
| PubChem CID | 4714951 |
|---|---|
| CAS | 128071-75-0 |
| Molecular Weight (g/mol) | 186 |
| MDL Number | MFCD04966945 |
| SMILES | C1=CC(=C(N=C1)Br)C=O |
| Synonym | 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde |
| IUPAC Name | 2-bromopyridine-3-carbaldehyde |
| InChI Key | GNFWMEFWZWXLIN-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
| CAS | 6240-11-5 |
|---|---|
| MDL Number | MFCD00074756 |
2-Bromo-2',4'-dimethoxyacetophenone, 98%
CAS: 60965-26-6 Molecular Formula: C10H11BrO3 Molecular Weight (g/mol): 259.09 MDL Number: MFCD00000197 InChI Key: PKVBZABQCCQHLD-UHFFFAOYSA-N Synonym: 2-bromo-1-2,4-dimethoxyphenyl ethanone,2-bromo-2',4'-dimethoxyacetophenone,2,4-dimethoxyphenacyl bromide,2-bromo-1-2',4'-dimethoxyphenyl ethanone,2-bromo-1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 2-bromo-1-2,4-dimethoxyphenyl,2-bromo-2',4'-dimethoxyacetopheneone,1-2,4-dimethoxyphenyl-2-bromoethan-1-one,pubchem13433,acmc-1ba4l PubChem CID: 98683 IUPAC Name: 2-bromo-1-(2,4-dimethoxyphenyl)ethanone SMILES: COC1=CC(=C(C=C1)C(=O)CBr)OC
| PubChem CID | 98683 |
|---|---|
| CAS | 60965-26-6 |
| Molecular Weight (g/mol) | 259.09 |
| MDL Number | MFCD00000197 |
| SMILES | COC1=CC(=C(C=C1)C(=O)CBr)OC |
| Synonym | 2-bromo-1-2,4-dimethoxyphenyl ethanone,2-bromo-2',4'-dimethoxyacetophenone,2,4-dimethoxyphenacyl bromide,2-bromo-1-2',4'-dimethoxyphenyl ethanone,2-bromo-1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 2-bromo-1-2,4-dimethoxyphenyl,2-bromo-2',4'-dimethoxyacetopheneone,1-2,4-dimethoxyphenyl-2-bromoethan-1-one,pubchem13433,acmc-1ba4l |
| IUPAC Name | 2-bromo-1-(2,4-dimethoxyphenyl)ethanone |
| InChI Key | PKVBZABQCCQHLD-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO3 |
2-Acetylpyridine, 98%
CAS: 1122-62-9 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006303 InChI Key: AJKVQEKCUACUMD-UHFFFAOYSA-N Synonym: 2-acetylpyridine,1-pyridin-2-yl ethanone,methyl 2-pyridyl ketone,2-acetopyridine,2-pyridyl methyl ketone,acetylpyridine,ethanone, 1-2-pyridinyl,ketone, methyl 2-pyridyl,1-pyridin-2-yl ethan-1-one,1-2-pyridinyl ethanone PubChem CID: 14286 IUPAC Name: 1-pyridin-2-ylethanone SMILES: CC(=O)C1=CC=CC=N1
| PubChem CID | 14286 |
|---|---|
| CAS | 1122-62-9 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006303 |
| SMILES | CC(=O)C1=CC=CC=N1 |
| Synonym | 2-acetylpyridine,1-pyridin-2-yl ethanone,methyl 2-pyridyl ketone,2-acetopyridine,2-pyridyl methyl ketone,acetylpyridine,ethanone, 1-2-pyridinyl,ketone, methyl 2-pyridyl,1-pyridin-2-yl ethan-1-one,1-2-pyridinyl ethanone |
| IUPAC Name | 1-pyridin-2-ylethanone |
| InChI Key | AJKVQEKCUACUMD-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
3-Fluoro-4-hydroxybenzaldehyde, 98%
CAS: 405-05-0 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00016626 InChI Key: QSBHJTCAPWOIIE-UHFFFAOYSA-N Synonym: 3-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 3-fluoro-4-hydroxy,4-hydroxy-3-fluorobenzaldehyde,pubchem1443,acmc-1acq8,ksc497m8t,3-fluoro-4 hydroxybenzaldehyde,4-hydroxy-3-fluoro-benzaldehyde,#,3-fluoranyl-4-oxidanyl-benzaldehyde PubChem CID: 587250 IUPAC Name: 3-fluoro-4-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1C=O)F)O
| PubChem CID | 587250 |
|---|---|
| CAS | 405-05-0 |
| Molecular Weight (g/mol) | 140.113 |
| MDL Number | MFCD00016626 |
| SMILES | C1=CC(=C(C=C1C=O)F)O |
| Synonym | 3-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 3-fluoro-4-hydroxy,4-hydroxy-3-fluorobenzaldehyde,pubchem1443,acmc-1acq8,ksc497m8t,3-fluoro-4 hydroxybenzaldehyde,4-hydroxy-3-fluoro-benzaldehyde,#,3-fluoranyl-4-oxidanyl-benzaldehyde |
| IUPAC Name | 3-fluoro-4-hydroxybenzaldehyde |
| InChI Key | QSBHJTCAPWOIIE-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO2 |
Inositol, 97%, Spectrum™ Chemical
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CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: OC1C(O)C(O)C(O)C(O)C1O
| CAS | 87-89-8 |
|---|---|
| Molecular Weight (g/mol) | 180.16 |
| SMILES | OC1C(O)C(O)C(O)C(O)C1O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
Gossypol-acetic acid
CAS: 12542-36-8 Molecular Formula: C32H34O10 Molecular Weight (g/mol): 578.614 MDL Number: MFCD00058385 InChI Key: NIOHNDKHQHVLKA-UHFFFAOYSA-N Synonym: gossypol-acetic acid,gossypol acetate,gossypol acetic acid,acetate gossypol,--gossypol acetic acid,s-gossypol acetic acid,at-101 acetic acid,gossypol-acetic acid complex PubChem CID: 227456 IUPAC Name: acetic acid;7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde SMILES: CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)O)O)C(C)C)O)C3=C(C=C4C(=C3O)C(=C(C(=C4C(C)C)O)O)C=O)C.CC(=O)O
| PubChem CID | 227456 |
|---|---|
| CAS | 12542-36-8 |
| Molecular Weight (g/mol) | 578.614 |
| MDL Number | MFCD00058385 |
| SMILES | CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)O)O)C(C)C)O)C3=C(C=C4C(=C3O)C(=C(C(=C4C(C)C)O)O)C=O)C.CC(=O)O |
| Synonym | gossypol-acetic acid,gossypol acetate,gossypol acetic acid,acetate gossypol,--gossypol acetic acid,s-gossypol acetic acid,at-101 acetic acid,gossypol-acetic acid complex |
| IUPAC Name | acetic acid;7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde |
| InChI Key | NIOHNDKHQHVLKA-UHFFFAOYSA-N |
| Molecular Formula | C32H34O10 |
2-(Hydroxymethyl)pyridine-5-boronic acid, 97%
CAS: 913835-98-0 Molecular Formula: C6H8BNO3 Molecular Weight (g/mol): 152.944 MDL Number: MFCD09027230 InChI Key: MSUQKXAJTUAESD-UHFFFAOYSA-N Synonym: 6-hydroxymethyl pyridin-3-yl boronic acid,6-hydroxymethyl pyridine-3-boronic acid,2-hydroxymethyl pyridine-5-boronic acid,6-hydroxymethyl pyridin-3-ylboronic acid,boronicacid, b-6-hydroxymethyl-3-pyridinyl,5-boronopyridin-2-yl methanol,6-hydroxymethyl-3-pyridineboronic acid,acmc-209raj,6-hydroxymethyl-3-pyridyl boronic acid PubChem CID: 44118255 IUPAC Name: [6-(hydroxymethyl)pyridin-3-yl]boronic acid SMILES: B(C1=CN=C(C=C1)CO)(O)O
| PubChem CID | 44118255 |
|---|---|
| CAS | 913835-98-0 |
| Molecular Weight (g/mol) | 152.944 |
| MDL Number | MFCD09027230 |
| SMILES | B(C1=CN=C(C=C1)CO)(O)O |
| Synonym | 6-hydroxymethyl pyridin-3-yl boronic acid,6-hydroxymethyl pyridine-3-boronic acid,2-hydroxymethyl pyridine-5-boronic acid,6-hydroxymethyl pyridin-3-ylboronic acid,boronicacid, b-6-hydroxymethyl-3-pyridinyl,5-boronopyridin-2-yl methanol,6-hydroxymethyl-3-pyridineboronic acid,acmc-209raj,6-hydroxymethyl-3-pyridyl boronic acid |
| IUPAC Name | [6-(hydroxymethyl)pyridin-3-yl]boronic acid |
| InChI Key | MSUQKXAJTUAESD-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNO3 |