Organooxygen compounds
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Ethyl 3,3-diethoxypropionate, 96%
CAS: 10601-80-6 Molecular Formula: C9H18O4 Molecular Weight (g/mol): 190.239 MDL Number: MFCD00009865 InChI Key: SIALOQYKFQEKOG-UHFFFAOYSA-N PubChem CID: 66389 IUPAC Name: ethyl 3,3-diethoxypropanoate SMILES: CCOC(CC(=O)OCC)OCC
| PubChem CID | 66389 |
|---|---|
| CAS | 10601-80-6 |
| Molecular Weight (g/mol) | 190.239 |
| MDL Number | MFCD00009865 |
| SMILES | CCOC(CC(=O)OCC)OCC |
| IUPAC Name | ethyl 3,3-diethoxypropanoate |
| InChI Key | SIALOQYKFQEKOG-UHFFFAOYSA-N |
| Molecular Formula | C9H18O4 |
5-Methoxy-2-methylindole, 99+%
CAS: 1076-74-0 Molecular Formula: C10H11NO Molecular Weight (g/mol): 161.20 MDL Number: MFCD00005620 InChI Key: VSWGLJOQFUMFOQ-UHFFFAOYSA-N Synonym: 5-methoxy-2-methylindole,2-methyl-5-methoxyindole,1h-indole, 5-methoxy-2-methyl,indole, 5-methoxy-2-methyl,pubchem7236,acmc-1buiu,maybridge1_002343,5-methoxy-2 methylindole,2-methyl-5-methoxylindole,2-methyl-5-methoxy indole PubChem CID: 70642 IUPAC Name: 5-methoxy-2-methyl-1H-indole SMILES: COC1=CC=C2NC(C)=CC2=C1
| PubChem CID | 70642 |
|---|---|
| CAS | 1076-74-0 |
| Molecular Weight (g/mol) | 161.20 |
| MDL Number | MFCD00005620 |
| SMILES | COC1=CC=C2NC(C)=CC2=C1 |
| Synonym | 5-methoxy-2-methylindole,2-methyl-5-methoxyindole,1h-indole, 5-methoxy-2-methyl,indole, 5-methoxy-2-methyl,pubchem7236,acmc-1buiu,maybridge1_002343,5-methoxy-2 methylindole,2-methyl-5-methoxylindole,2-methyl-5-methoxy indole |
| IUPAC Name | 5-methoxy-2-methyl-1H-indole |
| InChI Key | VSWGLJOQFUMFOQ-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO |
Bromomethyl methyl ether, 90%
CAS: 13057-17-5 Molecular Formula: C2H5BrO Molecular Weight (g/mol): 124.97 InChI Key: JAMFGQBENKSWOF-UHFFFAOYSA-N Synonym: bromomethyl methyl ether,methane, bromomethoxy,bromo methoxy methane,methoxymethyl bromide,ether, bromomethyl methyl,bromomethylmethylether,methoxymethylbromide,mombr,bromo-methoxy-methane,bromomethyl methylether PubChem CID: 83093 IUPAC Name: bromo(methoxy)methane SMILES: COCBr
| PubChem CID | 83093 |
|---|---|
| CAS | 13057-17-5 |
| Molecular Weight (g/mol) | 124.97 |
| SMILES | COCBr |
| Synonym | bromomethyl methyl ether,methane, bromomethoxy,bromo methoxy methane,methoxymethyl bromide,ether, bromomethyl methyl,bromomethylmethylether,methoxymethylbromide,mombr,bromo-methoxy-methane,bromomethyl methylether |
| IUPAC Name | bromo(methoxy)methane |
| InChI Key | JAMFGQBENKSWOF-UHFFFAOYSA-N |
| Molecular Formula | C2H5BrO |
2-Amino-6-methoxybenzothiazole, 98%
CAS: 1747-60-0 Molecular Formula: C8H8N2OS Molecular Weight (g/mol): 180.23 MDL Number: MFCD00005787 InChI Key: KZHGPDSVHSDCMX-UHFFFAOYSA-N Synonym: 2-amino-6-methoxybenzothiazole,6-methoxybenzo d thiazol-2-amine,2-benzothiazolamine, 6-methoxy,6-methoxy-2-aminobenzothiazole,2-amino-6-methoxy benzothiazole,benzothiazole, 2-amino-6-methoxy,6-methoxy-2-benzothiazolamine,6-methoxybenzothiazol-2-ylamine,unii-lat2842yvx,ccris 1393 PubChem CID: 15630 IUPAC Name: 6-methoxy-1,3-benzothiazol-2-amine SMILES: COC1=CC2=C(C=C1)N=C(S2)N
| PubChem CID | 15630 |
|---|---|
| CAS | 1747-60-0 |
| Molecular Weight (g/mol) | 180.23 |
| MDL Number | MFCD00005787 |
| SMILES | COC1=CC2=C(C=C1)N=C(S2)N |
| Synonym | 2-amino-6-methoxybenzothiazole,6-methoxybenzo d thiazol-2-amine,2-benzothiazolamine, 6-methoxy,6-methoxy-2-aminobenzothiazole,2-amino-6-methoxy benzothiazole,benzothiazole, 2-amino-6-methoxy,6-methoxy-2-benzothiazolamine,6-methoxybenzothiazol-2-ylamine,unii-lat2842yvx,ccris 1393 |
| IUPAC Name | 6-methoxy-1,3-benzothiazol-2-amine |
| InChI Key | KZHGPDSVHSDCMX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2OS |
trans-2-Decenal, 95%
CAS: 3913-81-3 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00014679 InChI Key: MMFCJPPRCYDLLZ-CMDGGOBGSA-N Synonym: trans-2-decenal,e-dec-2-enal,2-decenal,decenal,e-2-decenal,3-heptylacrolein,decenaldehyde,decylenic aldehyde,2-decenal, 2e,2-decenal, e PubChem CID: 5283345 IUPAC Name: (2E)-dec-2-enal SMILES: CCCCCCC\C=C\C=O
| PubChem CID | 5283345 |
|---|---|
| CAS | 3913-81-3 |
| Molecular Weight (g/mol) | 154.25 |
| MDL Number | MFCD00014679 |
| SMILES | CCCCCCC\C=C\C=O |
| Synonym | trans-2-decenal,e-dec-2-enal,2-decenal,decenal,e-2-decenal,3-heptylacrolein,decenaldehyde,decylenic aldehyde,2-decenal, 2e,2-decenal, e |
| IUPAC Name | (2E)-dec-2-enal |
| InChI Key | MMFCJPPRCYDLLZ-CMDGGOBGSA-N |
| Molecular Formula | C10H18O |
7-Bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 852054-42-3 Molecular Formula: C7H5BrO3S Molecular Weight (g/mol): 249.078 MDL Number: MFCD08690306 InChI Key: YEKBJVHBVICUOZ-UHFFFAOYSA-N Synonym: 7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,2,3-dihydro-7-bromothieno 3,4-b 1,4 dioxin-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,7-bromo-2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde,7-bromo-2,3-dihydro PubChem CID: 11391008 IUPAC Name: 5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-7-carbaldehyde SMILES: C1COC2=C(SC(=C2O1)C=O)Br
| PubChem CID | 11391008 |
|---|---|
| CAS | 852054-42-3 |
| Molecular Weight (g/mol) | 249.078 |
| MDL Number | MFCD08690306 |
| SMILES | C1COC2=C(SC(=C2O1)C=O)Br |
| Synonym | 7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,2,3-dihydro-7-bromothieno 3,4-b 1,4 dioxin-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,7-bromo-2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde,7-bromo-2,3-dihydro |
| IUPAC Name | 5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-7-carbaldehyde |
| InChI Key | YEKBJVHBVICUOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO3S |
5,6-Dimethoxybenzimidazole, 98%
CAS: 72721-02-9 Molecular Formula: C9H10N2O2 Molecular Weight (g/mol): 178.191 MDL Number: MFCD00612461 InChI Key: BTWUUHKQHOSMIN-UHFFFAOYSA-N PubChem CID: 601221 IUPAC Name: 5,6-dimethoxy-1H-benzimidazole SMILES: COC1=C(C=C2C(=C1)NC=N2)OC
| PubChem CID | 601221 |
|---|---|
| CAS | 72721-02-9 |
| Molecular Weight (g/mol) | 178.191 |
| MDL Number | MFCD00612461 |
| SMILES | COC1=C(C=C2C(=C1)NC=N2)OC |
| IUPAC Name | 5,6-dimethoxy-1H-benzimidazole |
| InChI Key | BTWUUHKQHOSMIN-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2O2 |
4'-Bromo-2,2,2-trifluoroacetophenone, 97%
CAS: 16184-89-7 Molecular Formula: C8H4BrF3O Molecular Weight (g/mol): 253.018 MDL Number: MFCD00191862 InChI Key: IHGSAQHSAGRWNI-UHFFFAOYSA-N Synonym: 4'-bromo-2,2,2-trifluoroacetophenone,1-4-bromophenyl-2,2,2-trifluoroethanone,1-4-bromophenyl-2,2,2-trifluoroethan-1-one,1-4-bromo-phenyl-2,2,2-trifluoro-ethanone,ethanone, 1-4-bromophenyl-2,2,2-trifluoro,1-4-bromophenyl-2,2,2-trifluoro-1-ethanone,intermediates-zcf02216,4-trifluoroacetylbromobenzene,4'-bromo-2,2,2-trifluoracetophenone,4'-bromo-2,2,2-trifluoroaceto-phenone PubChem CID: 603866 IUPAC Name: 1-(4-bromophenyl)-2,2,2-trifluoroethanone SMILES: C1=CC(=CC=C1C(=O)C(F)(F)F)Br
| PubChem CID | 603866 |
|---|---|
| CAS | 16184-89-7 |
| Molecular Weight (g/mol) | 253.018 |
| MDL Number | MFCD00191862 |
| SMILES | C1=CC(=CC=C1C(=O)C(F)(F)F)Br |
| Synonym | 4'-bromo-2,2,2-trifluoroacetophenone,1-4-bromophenyl-2,2,2-trifluoroethanone,1-4-bromophenyl-2,2,2-trifluoroethan-1-one,1-4-bromo-phenyl-2,2,2-trifluoro-ethanone,ethanone, 1-4-bromophenyl-2,2,2-trifluoro,1-4-bromophenyl-2,2,2-trifluoro-1-ethanone,intermediates-zcf02216,4-trifluoroacetylbromobenzene,4'-bromo-2,2,2-trifluoracetophenone,4'-bromo-2,2,2-trifluoroaceto-phenone |
| IUPAC Name | 1-(4-bromophenyl)-2,2,2-trifluoroethanone |
| InChI Key | IHGSAQHSAGRWNI-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrF3O |
trans-2-Methyl-2-butenal, 97%
CAS: 497-03-0 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00006977 InChI Key: ACWQBUSCFPJUPN-HWKANZROSA-N Synonym: tiglic aldehyde,trans-2-methyl-2-butenal,tiglaldehyde,2-methylbut-2-enal,e-2-methylbut-2-enal,tiglic acid aldehyde,e-2-methyl-2-butenal,2-butenal, 2-methyl-, e,tigaldehyde, trans,2-butenal, 2-methyl-, 2e PubChem CID: 5321950 IUPAC Name: (E)-2-methylbut-2-enal SMILES: CC=C(C)C=O
| PubChem CID | 5321950 |
|---|---|
| CAS | 497-03-0 |
| Molecular Weight (g/mol) | 84.118 |
| MDL Number | MFCD00006977 |
| SMILES | CC=C(C)C=O |
| Synonym | tiglic aldehyde,trans-2-methyl-2-butenal,tiglaldehyde,2-methylbut-2-enal,e-2-methylbut-2-enal,tiglic acid aldehyde,e-2-methyl-2-butenal,2-butenal, 2-methyl-, e,tigaldehyde, trans,2-butenal, 2-methyl-, 2e |
| IUPAC Name | (E)-2-methylbut-2-enal |
| InChI Key | ACWQBUSCFPJUPN-HWKANZROSA-N |
| Molecular Formula | C5H8O |
5,6-Dimethoxy-1-indanone, 97%
CAS: 2107-69-9 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00003790 InChI Key: IHMQOBPGHZFGLC-UHFFFAOYSA-N Synonym: 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on PubChem CID: 75018 IUPAC Name: 5,6-dimethoxy-2,3-dihydroinden-1-one SMILES: COC1=C(C=C2C(=C1)CCC2=O)OC
| PubChem CID | 75018 |
|---|---|
| CAS | 2107-69-9 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD00003790 |
| SMILES | COC1=C(C=C2C(=C1)CCC2=O)OC |
| Synonym | 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on |
| IUPAC Name | 5,6-dimethoxy-2,3-dihydroinden-1-one |
| InChI Key | IHMQOBPGHZFGLC-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
1,1,1-Trifluoro-2-butanone, 96%
CAS: 381-88-4 Molecular Formula: C4H5F3O Molecular Weight (g/mol): 126.08 MDL Number: MFCD00190641 InChI Key: QBVHMPFSDVNFAY-UHFFFAOYSA-N Synonym: 1,1,1-trifluoro-2-butanone,1,1,1-trifluorobutane-2-one,2-butanone, 1,1,1-trifluoro,1,1,1-trifluoromethyl ethyl ketone,trifluoro-2-butanone,acmc-20ap8w,trifluoromethylethylketone,ethyl trifluoromethyl ketone,trifluoromethyl ethyl ketone,1,1-trifluoro-2-butanone PubChem CID: 238288 IUPAC Name: 1,1,1-trifluorobutan-2-one SMILES: CCC(=O)C(F)(F)F
| PubChem CID | 238288 |
|---|---|
| CAS | 381-88-4 |
| Molecular Weight (g/mol) | 126.08 |
| MDL Number | MFCD00190641 |
| SMILES | CCC(=O)C(F)(F)F |
| Synonym | 1,1,1-trifluoro-2-butanone,1,1,1-trifluorobutane-2-one,2-butanone, 1,1,1-trifluoro,1,1,1-trifluoromethyl ethyl ketone,trifluoro-2-butanone,acmc-20ap8w,trifluoromethylethylketone,ethyl trifluoromethyl ketone,trifluoromethyl ethyl ketone,1,1-trifluoro-2-butanone |
| IUPAC Name | 1,1,1-trifluorobutan-2-one |
| InChI Key | QBVHMPFSDVNFAY-UHFFFAOYSA-N |
| Molecular Formula | C4H5F3O |
2,4-Dimethoxypyrimidine-5-boronic acid pinacol ester, 97%, Thermo Scientific Chemicals
CAS: 936250-17-8 Molecular Formula: C12H19BN2O4 Molecular Weight (g/mol): 266.10 MDL Number: MFCD06795654 InChI Key: RKHZHTLJEUBARP-UHFFFAOYSA-N Synonym: 2,4-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronic acid pinacol ester,2,6-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronic acid, pinacol ester,2,4-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-pyrimidine,2,4-dimethoxy-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronicacidpinacolester,2,4-dimethoxyprimidine-5-boronic acid pinacol ester,2,6-dimethoxypyrimidine-5-boronic acid, pinacol ester PubChem CID: 16218388 IUPAC Name: 2,4-dimethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine SMILES: COC1=NC=C(B2OC(C)(C)C(C)(C)O2)C(OC)=N1
| PubChem CID | 16218388 |
|---|---|
| CAS | 936250-17-8 |
| Molecular Weight (g/mol) | 266.10 |
| MDL Number | MFCD06795654 |
| SMILES | COC1=NC=C(B2OC(C)(C)C(C)(C)O2)C(OC)=N1 |
| Synonym | 2,4-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronic acid pinacol ester,2,6-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronic acid, pinacol ester,2,4-dimethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-pyrimidine,2,4-dimethoxy-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrimidine,2,4-dimethoxypyrimidine-5-boronicacidpinacolester,2,4-dimethoxyprimidine-5-boronic acid pinacol ester,2,6-dimethoxypyrimidine-5-boronic acid, pinacol ester |
| IUPAC Name | 2,4-dimethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine |
| InChI Key | RKHZHTLJEUBARP-UHFFFAOYSA-N |
| Molecular Formula | C12H19BN2O4 |
3,4-Di-n-butoxy-3-cyclobutene-1,2-dione, 97%
CAS: 2892-62-8 Molecular Formula: C12H18O4 Molecular Weight (g/mol): 226.27 MDL Number: MFCD00037150 InChI Key: XBRWELTXMQSEIN-UHFFFAOYSA-N Synonym: dibutyl squarate,3,4-dibutoxy-3-cyclobutene-1,2-dione,squaric acid dibutyl ester,sadbe,squaric acid dibutylester,3,4-di-n-butoxy-3-cyclobutene-1,2-dione,unii-4rto57vg65,1,2-dibutyl squarate,3-cyclobutene-1,2-dione, 3,4-dibutoxy,acmc-209h5p PubChem CID: 65108 ChEBI: CHEBI:53612 IUPAC Name: 3,4-dibutoxycyclobut-3-ene-1,2-dione SMILES: CCCCOC1=C(OCCCC)C(=O)C1=O
| PubChem CID | 65108 |
|---|---|
| CAS | 2892-62-8 |
| Molecular Weight (g/mol) | 226.27 |
| ChEBI | CHEBI:53612 |
| MDL Number | MFCD00037150 |
| SMILES | CCCCOC1=C(OCCCC)C(=O)C1=O |
| Synonym | dibutyl squarate,3,4-dibutoxy-3-cyclobutene-1,2-dione,squaric acid dibutyl ester,sadbe,squaric acid dibutylester,3,4-di-n-butoxy-3-cyclobutene-1,2-dione,unii-4rto57vg65,1,2-dibutyl squarate,3-cyclobutene-1,2-dione, 3,4-dibutoxy,acmc-209h5p |
| IUPAC Name | 3,4-dibutoxycyclobut-3-ene-1,2-dione |
| InChI Key | XBRWELTXMQSEIN-UHFFFAOYSA-N |
| Molecular Formula | C12H18O4 |
Trimethyl orthoacetate, 98+%
CAS: 1445-45-0 Molecular Formula: C5H12O3 Molecular Weight (g/mol): 120.15 MDL Number: MFCD00008477 InChI Key: HDPNBNXLBDFELL-UHFFFAOYSA-N Synonym: trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate PubChem CID: 15050 IUPAC Name: 1,1,1-trimethoxyethane SMILES: CC(OC)(OC)OC
| PubChem CID | 15050 |
|---|---|
| CAS | 1445-45-0 |
| Molecular Weight (g/mol) | 120.15 |
| MDL Number | MFCD00008477 |
| SMILES | CC(OC)(OC)OC |
| Synonym | trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate |
| IUPAC Name | 1,1,1-trimethoxyethane |
| InChI Key | HDPNBNXLBDFELL-UHFFFAOYSA-N |
| Molecular Formula | C5H12O3 |