Organooxygen compounds
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6-(Bromomethyl)-3,4-dihydro-2H-1,5-benzodioxepine, 97%, Thermo Scientific™
CAS: 499770-96-6 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.10 MDL Number: MFCD05664399 InChI Key: QDRNTKFXSFDJCH-UHFFFAOYSA-N Synonym: 6-bromomethyl-3,4-dihydro-2h-1,5-benzodioxepine,2h-1,5-benzodioxepin, 6-bromomethyl-3,4-dihydro,6-bromomethyl-3,4-dihydro-1,5-benzodioxepin,6-bromomethyl-2h,3h,4h-benzo b 1,4-dioxepin PubChem CID: 2794992 IUPAC Name: 6-(bromomethyl)-3,4-dihydro-2H-1,5-benzodioxepine SMILES: BrCC1=C2OCCCOC2=CC=C1
| PubChem CID | 2794992 |
|---|---|
| CAS | 499770-96-6 |
| Molecular Weight (g/mol) | 243.10 |
| MDL Number | MFCD05664399 |
| SMILES | BrCC1=C2OCCCOC2=CC=C1 |
| Synonym | 6-bromomethyl-3,4-dihydro-2h-1,5-benzodioxepine,2h-1,5-benzodioxepin, 6-bromomethyl-3,4-dihydro,6-bromomethyl-3,4-dihydro-1,5-benzodioxepin,6-bromomethyl-2h,3h,4h-benzo b 1,4-dioxepin |
| IUPAC Name | 6-(bromomethyl)-3,4-dihydro-2H-1,5-benzodioxepine |
| InChI Key | QDRNTKFXSFDJCH-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO2 |
sec-Butyl methyl ether, 99%
CAS: 6795-87-5 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00190205 InChI Key: FVNIMHIOIXPIQT-UHFFFAOYNA-N Synonym: sec-butyl methyl ether,butane, 2-methoxy,methyl sec-butyl ether,ether, sec-butyl methyl,2-butyl methyl ether,methyl 1-methylpropyl ether,s-butyl methyl ether,butane, 2-methoxy-9ci,butane,2-methoxy,acmc-1b64a PubChem CID: 23238 IUPAC Name: 2-methoxybutane SMILES: CCC(C)OC
| PubChem CID | 23238 |
|---|---|
| CAS | 6795-87-5 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00190205 |
| SMILES | CCC(C)OC |
| Synonym | sec-butyl methyl ether,butane, 2-methoxy,methyl sec-butyl ether,ether, sec-butyl methyl,2-butyl methyl ether,methyl 1-methylpropyl ether,s-butyl methyl ether,butane, 2-methoxy-9ci,butane,2-methoxy,acmc-1b64a |
| IUPAC Name | 2-methoxybutane |
| InChI Key | FVNIMHIOIXPIQT-UHFFFAOYNA-N |
| Molecular Formula | C5H12O |
5,6-Dimethoxyindole-2-carboxylic acid, 98%
CAS: 88210-96-2 Molecular Formula: C11H11NO4 Molecular Weight (g/mol): 221.21 MDL Number: MFCD00015459 InChI Key: UZHQHNDRVITJPL-UHFFFAOYSA-N Synonym: 5,6-dimethoxyindole-2-carboxylic acid,5,6-dimethoyxindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5,6-dimethoxy,5,6-dica,5,6-dimethoxyindole-2-carboxylicacid,5,6-dimethoxyindolyl-2-carboxylic acid,1h-indole-2-carboxylicacid, 5,6-dimethoxy PubChem CID: 139035 IUPAC Name: 5,6-dimethoxy-1H-indole-2-carboxylic acid SMILES: COC1=C(OC)C=C2C=C(NC2=C1)C(O)=O
| PubChem CID | 139035 |
|---|---|
| CAS | 88210-96-2 |
| Molecular Weight (g/mol) | 221.21 |
| MDL Number | MFCD00015459 |
| SMILES | COC1=C(OC)C=C2C=C(NC2=C1)C(O)=O |
| Synonym | 5,6-dimethoxyindole-2-carboxylic acid,5,6-dimethoyxindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5,6-dimethoxy,5,6-dica,5,6-dimethoxyindole-2-carboxylicacid,5,6-dimethoxyindolyl-2-carboxylic acid,1h-indole-2-carboxylicacid, 5,6-dimethoxy |
| IUPAC Name | 5,6-dimethoxy-1H-indole-2-carboxylic acid |
| InChI Key | UZHQHNDRVITJPL-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO4 |
Benzo-18-crown-6, 97%
CAS: 14098-24-9 Molecular Formula: C16H24O6 Molecular Weight (g/mol): 312.362 MDL Number: MFCD00062741 InChI Key: DSFHXKRFDFROER-UHFFFAOYSA-N PubChem CID: 585779 IUPAC Name: 2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene SMILES: C1COCCOCCOC2=CC=CC=C2OCCOCCO1
| PubChem CID | 585779 |
|---|---|
| CAS | 14098-24-9 |
| Molecular Weight (g/mol) | 312.362 |
| MDL Number | MFCD00062741 |
| SMILES | C1COCCOCCOC2=CC=CC=C2OCCOCCO1 |
| IUPAC Name | 2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene |
| InChI Key | DSFHXKRFDFROER-UHFFFAOYSA-N |
| Molecular Formula | C16H24O6 |
Cyclocytidine hydrochloride, 98+%, Thermo Scientific Chemicals
CAS: 10212-25-6 Molecular Formula: C9H12ClN3O4 Molecular Weight (g/mol): 261.66 MDL Number: MFCD00012636 InChI Key: KZOWNALBTMILAP-JBMRGDGGSA-N Synonym: cyclocytidine hydrochloride 1g PubChem CID: 74764394 ChEBI: CHEBI:74843 IUPAC Name: (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydron;chloride SMILES: Cl.OC[C@H]1O[C@@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O
| PubChem CID | 74764394 |
|---|---|
| CAS | 10212-25-6 |
| Molecular Weight (g/mol) | 261.66 |
| ChEBI | CHEBI:74843 |
| MDL Number | MFCD00012636 |
| SMILES | Cl.OC[C@H]1O[C@@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O |
| Synonym | cyclocytidine hydrochloride 1g |
| IUPAC Name | (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydron;chloride |
| InChI Key | KZOWNALBTMILAP-JBMRGDGGSA-N |
| Molecular Formula | C9H12ClN3O4 |
6-Methoxypyridine-2-boronic acid pinacol ester, 97%
CAS: 1034297-69-2 Molecular Formula: C12H18BNO3 Molecular Weight (g/mol): 235.09 MDL Number: MFCD06798266 InChI Key: VYWCRVNLPOVYJH-UHFFFAOYSA-N Synonym: 2-methoxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,6-methoxypyridine-2-boronic acid pinacol ester,pyridine,2-methoxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,6-methoxy pyridine-2-boronic acid pinacol ester,6-methoxypyridine-2-boronicacidpinacolester,6-methoxypyridin-2-ylboronic acid pinacol ester,6-methoxypyridin-2-yl boronic acid pinacol ester,2-methoxy-6-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-6-methoxy-2-pyridinyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-methyloxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine PubChem CID: 17750508 IUPAC Name: 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)OC
| PubChem CID | 17750508 |
|---|---|
| CAS | 1034297-69-2 |
| Molecular Weight (g/mol) | 235.09 |
| MDL Number | MFCD06798266 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)OC |
| Synonym | 2-methoxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,6-methoxypyridine-2-boronic acid pinacol ester,pyridine,2-methoxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,6-methoxy pyridine-2-boronic acid pinacol ester,6-methoxypyridine-2-boronicacidpinacolester,6-methoxypyridin-2-ylboronic acid pinacol ester,6-methoxypyridin-2-yl boronic acid pinacol ester,2-methoxy-6-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-6-methoxy-2-pyridinyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-methyloxy-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine |
| IUPAC Name | 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI Key | VYWCRVNLPOVYJH-UHFFFAOYSA-N |
| Molecular Formula | C12H18BNO3 |
4-Hydroxy-2(5H)-furanone, 95%
CAS: 541-57-1 Molecular Formula: C4H4O3 Molecular Weight (g/mol): 100.07 MDL Number: MFCD00052187 InChI Key: JZQBAGOECGRTSA-UHFFFAOYSA-N Synonym: 4-hydroxyfuran-2 5h-one,4-hydroxy-2,5-dihydrofuran-2-one,4-hydroxy-2 5h-furanone,2 5h-furanone, 4-hydroxy,4-hydroxy-5h-furan-2-one,5-hydroxyfuran-3-one,5-hydroxyfuran-3 2h-one,pubchem21770,acmc-209xna,tetronic acid 5g PubChem CID: 54683813 IUPAC Name: 3-hydroxy-2H-furan-5-one SMILES: OC1=CC(=O)OC1
| PubChem CID | 54683813 |
|---|---|
| CAS | 541-57-1 |
| Molecular Weight (g/mol) | 100.07 |
| MDL Number | MFCD00052187 |
| SMILES | OC1=CC(=O)OC1 |
| Synonym | 4-hydroxyfuran-2 5h-one,4-hydroxy-2,5-dihydrofuran-2-one,4-hydroxy-2 5h-furanone,2 5h-furanone, 4-hydroxy,4-hydroxy-5h-furan-2-one,5-hydroxyfuran-3-one,5-hydroxyfuran-3 2h-one,pubchem21770,acmc-209xna,tetronic acid 5g |
| IUPAC Name | 3-hydroxy-2H-furan-5-one |
| InChI Key | JZQBAGOECGRTSA-UHFFFAOYSA-N |
| Molecular Formula | C4H4O3 |
4-(2-Morpholin-4-ylethoxy)benzonitrile, 95%, Thermo Scientific™
CAS: 34334-04-8 Molecular Formula: C13H16N2O2 Molecular Weight (g/mol): 232.283 MDL Number: MFCD07772850 InChI Key: KQTJRPZKCNRDQC-UHFFFAOYSA-N Synonym: 4-2-morpholin-4-ylethoxy benzonitrile,4-2-morpholinoethoxy benzonitrile,4-2-morpholin-4-yl ethoxy benzonitrile,4-2-4-morpholinyl ethoxy benzonitrile,4-2-morpholin-4-yl-ethoxy-benzonitrile,benzonitrile,4-2-4-morpholinyl ethoxy,4-2-morpholin-4-ylethoxy benzenecarbonitrile,benzonitrile, 4-2-4-morpholinyl ethoxy PubChem CID: 2994074 IUPAC Name: 4-(2-morpholin-4-ylethoxy)benzonitrile SMILES: C1COCCN1CCOC2=CC=C(C=C2)C#N
| PubChem CID | 2994074 |
|---|---|
| CAS | 34334-04-8 |
| Molecular Weight (g/mol) | 232.283 |
| MDL Number | MFCD07772850 |
| SMILES | C1COCCN1CCOC2=CC=C(C=C2)C#N |
| Synonym | 4-2-morpholin-4-ylethoxy benzonitrile,4-2-morpholinoethoxy benzonitrile,4-2-morpholin-4-yl ethoxy benzonitrile,4-2-4-morpholinyl ethoxy benzonitrile,4-2-morpholin-4-yl-ethoxy-benzonitrile,benzonitrile,4-2-4-morpholinyl ethoxy,4-2-morpholin-4-ylethoxy benzenecarbonitrile,benzonitrile, 4-2-4-morpholinyl ethoxy |
| IUPAC Name | 4-(2-morpholin-4-ylethoxy)benzonitrile |
| InChI Key | KQTJRPZKCNRDQC-UHFFFAOYSA-N |
| Molecular Formula | C13H16N2O2 |
2-Isopropoxyethanol, 99%
CAS: 109-59-1 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00002866 InChI Key: HCGFUIQPSOCUHI-UHFFFAOYSA-N Synonym: 2-isopropoxyethanol,isopropyl oxitol,isopropyl cellosolve,dowanal eipat,ethanol, 2-isopropoxy,isopropyl glycol,ethylene glycol isopropyl ether,isopropoxyethanol,ethanol, 2-1-methylethoxy,ucar ac PubChem CID: 7996 IUPAC Name: 2-propan-2-yloxyethanol SMILES: CC(C)OCCO
| PubChem CID | 7996 |
|---|---|
| CAS | 109-59-1 |
| Molecular Weight (g/mol) | 104.15 |
| MDL Number | MFCD00002866 |
| SMILES | CC(C)OCCO |
| Synonym | 2-isopropoxyethanol,isopropyl oxitol,isopropyl cellosolve,dowanal eipat,ethanol, 2-isopropoxy,isopropyl glycol,ethylene glycol isopropyl ether,isopropoxyethanol,ethanol, 2-1-methylethoxy,ucar ac |
| IUPAC Name | 2-propan-2-yloxyethanol |
| InChI Key | HCGFUIQPSOCUHI-UHFFFAOYSA-N |
| Molecular Formula | C5H12O2 |
6-Methoxyquinoline, 98%
CAS: 5263-87-6 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00006800 InChI Key: HFDLDPJYCIEXJP-UHFFFAOYSA-N Synonym: quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q PubChem CID: 14860 ChEBI: CHEBI:72822 IUPAC Name: 6-methoxyquinoline SMILES: COC1=CC2=C(C=C1)N=CC=C2
| PubChem CID | 14860 |
|---|---|
| CAS | 5263-87-6 |
| Molecular Weight (g/mol) | 159.19 |
| ChEBI | CHEBI:72822 |
| MDL Number | MFCD00006800 |
| SMILES | COC1=CC2=C(C=C1)N=CC=C2 |
| Synonym | quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q |
| IUPAC Name | 6-methoxyquinoline |
| InChI Key | HFDLDPJYCIEXJP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
2-Methoxyfuran, 97%
CAS: 25414-22-6 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.101 MDL Number: MFCD00003227 InChI Key: OXCGHDNCMSOEBZ-UHFFFAOYSA-N PubChem CID: 117476 IUPAC Name: 2-methoxyfuran SMILES: COC1=CC=CO1
| PubChem CID | 117476 |
|---|---|
| CAS | 25414-22-6 |
| Molecular Weight (g/mol) | 98.101 |
| MDL Number | MFCD00003227 |
| SMILES | COC1=CC=CO1 |
| IUPAC Name | 2-methoxyfuran |
| InChI Key | OXCGHDNCMSOEBZ-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
2-[Di(methylthio)methylidene]malononitrile, 97%, Thermo Scientific™
CAS: 5147-80-8 Molecular Formula: C6H6N2S2 Molecular Weight (g/mol): 170.248 MDL Number: MFCD00052730 InChI Key: FICQFRCPSFCFBY-UHFFFAOYSA-N Synonym: 2-bis methylthio methylene malononitrile,bis methylthio methylene malononitrile,2-di methylthio methylidene malononitrile,propanedinitrile, bis methylthio methylene,2-bis methylsulfanyl methylidene propanedinitrile,bis methylthio methylene propanedinitrile,3,3-bis methylthio-2-cyanoacrylonitrile,bis methylthio methylidene propanedinitrile PubChem CID: 99229 IUPAC Name: 2-[bis(methylsulfanyl)methylidene]propanedinitrile SMILES: CSC(=C(C#N)C#N)SC
| PubChem CID | 99229 |
|---|---|
| CAS | 5147-80-8 |
| Molecular Weight (g/mol) | 170.248 |
| MDL Number | MFCD00052730 |
| SMILES | CSC(=C(C#N)C#N)SC |
| Synonym | 2-bis methylthio methylene malononitrile,bis methylthio methylene malononitrile,2-di methylthio methylidene malononitrile,propanedinitrile, bis methylthio methylene,2-bis methylsulfanyl methylidene propanedinitrile,bis methylthio methylene propanedinitrile,3,3-bis methylthio-2-cyanoacrylonitrile,bis methylthio methylidene propanedinitrile |
| IUPAC Name | 2-[bis(methylsulfanyl)methylidene]propanedinitrile |
| InChI Key | FICQFRCPSFCFBY-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2S2 |
4-Chromanol, 97%
CAS: 1481-93-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00006849 InChI Key: MGSHXMOLUWTMGP-UHFFFAOYSA-N PubChem CID: 92890 IUPAC Name: 3,4-dihydro-2H-chromen-4-ol SMILES: C1COC2=CC=CC=C2C1O
| PubChem CID | 92890 |
|---|---|
| CAS | 1481-93-2 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00006849 |
| SMILES | C1COC2=CC=CC=C2C1O |
| IUPAC Name | 3,4-dihydro-2H-chromen-4-ol |
| InChI Key | MGSHXMOLUWTMGP-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Chloroacetaldehyde dimethyl acetal, 97%
CAS: 97-97-2 Molecular Formula: C4H9ClO2 Molecular Weight (g/mol): 124.56 MDL Number: MFCD00000948 InChI Key: CRZJPEIBPQWDGJ-UHFFFAOYSA-N Synonym: chloroacetaldehyde dimethyl acetal,dimethylchloroacetal,dimethyl chloroacetal,dimethyl chloracetal,ethane, 2-chloro-1,1-dimethoxy,2-chloro-1,1-dimethoxy-ethane,chloroacetaldehyde, dimethyl acetal,2-chloroacetaldehyde, dimethyl acetal,methyl chloroacetal,1-chloro-2,2-dimethoxyethane PubChem CID: 60986 IUPAC Name: 2-chloro-1,1-dimethoxyethane SMILES: COC(CCl)OC
| PubChem CID | 60986 |
|---|---|
| CAS | 97-97-2 |
| Molecular Weight (g/mol) | 124.56 |
| MDL Number | MFCD00000948 |
| SMILES | COC(CCl)OC |
| Synonym | chloroacetaldehyde dimethyl acetal,dimethylchloroacetal,dimethyl chloroacetal,dimethyl chloracetal,ethane, 2-chloro-1,1-dimethoxy,2-chloro-1,1-dimethoxy-ethane,chloroacetaldehyde, dimethyl acetal,2-chloroacetaldehyde, dimethyl acetal,methyl chloroacetal,1-chloro-2,2-dimethoxyethane |
| IUPAC Name | 2-chloro-1,1-dimethoxyethane |
| InChI Key | CRZJPEIBPQWDGJ-UHFFFAOYSA-N |
| Molecular Formula | C4H9ClO2 |
6-Methoxy-2-methylbenzothiazole, 97%
CAS: 2941-72-2 Molecular Formula: C9H9NOS Molecular Weight (g/mol): 179.237 MDL Number: MFCD00005795 InChI Key: DYHLJSUORLPGNT-UHFFFAOYSA-N Synonym: 6-methoxy-2-methylbenzo d thiazole,6-methoxy-2-methylbenzothiazole,benzothiazole, 6-methoxy-2-methyl,2-methyl-6-methoxybenzothiazole,6-methoxy-2-methyl-benzothiazole,benzothiazole,6-methoxy-2-methyl,6-methoxy-2-methylbenzothiazol,#,benzothiazole, 6-methoxy-2-methyl-6ci,7ci,8ci,9ci PubChem CID: 76254 IUPAC Name: 6-methoxy-2-methyl-1,3-benzothiazole SMILES: CC1=NC2=C(S1)C=C(C=C2)OC
| PubChem CID | 76254 |
|---|---|
| CAS | 2941-72-2 |
| Molecular Weight (g/mol) | 179.237 |
| MDL Number | MFCD00005795 |
| SMILES | CC1=NC2=C(S1)C=C(C=C2)OC |
| Synonym | 6-methoxy-2-methylbenzo d thiazole,6-methoxy-2-methylbenzothiazole,benzothiazole, 6-methoxy-2-methyl,2-methyl-6-methoxybenzothiazole,6-methoxy-2-methyl-benzothiazole,benzothiazole,6-methoxy-2-methyl,6-methoxy-2-methylbenzothiazol,#,benzothiazole, 6-methoxy-2-methyl-6ci,7ci,8ci,9ci |
| IUPAC Name | 6-methoxy-2-methyl-1,3-benzothiazole |
| InChI Key | DYHLJSUORLPGNT-UHFFFAOYSA-N |
| Molecular Formula | C9H9NOS |