Organoheterocyclic compounds
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2-Methyl-6-nitrobenzoxazole, 98%
CAS: 5683-43-2 Molecular Formula: C8H6N2O3 Molecular Weight (g/mol): 178.147 MDL Number: MFCD00022848 InChI Key: DPVZLXWUFYMLBK-UHFFFAOYSA-N PubChem CID: 79766 IUPAC Name: 2-methyl-6-nitro-1,3-benzoxazole SMILES: CC1=NC2=C(O1)C=C(C=C2)[N+](=O)[O-]
| PubChem CID | 79766 |
|---|---|
| CAS | 5683-43-2 |
| Molecular Weight (g/mol) | 178.147 |
| MDL Number | MFCD00022848 |
| SMILES | CC1=NC2=C(O1)C=C(C=C2)[N+](=O)[O-] |
| IUPAC Name | 2-methyl-6-nitro-1,3-benzoxazole |
| InChI Key | DPVZLXWUFYMLBK-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O3 |
L-Gulonic acid-1,4-lactone, 95%
CAS: 1128-23-0 Molecular Formula: C6H10O6 Molecular Weight (g/mol): 178.14 MDL Number: MFCD00064331 InChI Key: SXZYCXMUPBBULW-SKNVOMKLSA-N Synonym: l-gulonolactone,l-gulono-1,4-lactone,l-gulonic acid gamma-lactone,3s,4r,5r-5-s-1,2-dihydroxyethyl-3,4-dihydroxydihydrofuran-2 3h-one,l-gulono-gamma-lactone,gamma-gulonolactone,l-gulonic gamma-lactone,l-+-gulono-1,4-lactone,l +-gulonic acid gamma-lactone,l-+-gulonic acid gamma-lactone PubChem CID: 439373 ChEBI: CHEBI:17587 IUPAC Name: (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-one SMILES: C(C(C1C(C(C(=O)O1)O)O)O)O
| PubChem CID | 439373 |
|---|---|
| CAS | 1128-23-0 |
| Molecular Weight (g/mol) | 178.14 |
| ChEBI | CHEBI:17587 |
| MDL Number | MFCD00064331 |
| SMILES | C(C(C1C(C(C(=O)O1)O)O)O)O |
| Synonym | l-gulonolactone,l-gulono-1,4-lactone,l-gulonic acid gamma-lactone,3s,4r,5r-5-s-1,2-dihydroxyethyl-3,4-dihydroxydihydrofuran-2 3h-one,l-gulono-gamma-lactone,gamma-gulonolactone,l-gulonic gamma-lactone,l-+-gulono-1,4-lactone,l +-gulonic acid gamma-lactone,l-+-gulonic acid gamma-lactone |
| IUPAC Name | (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-one |
| InChI Key | SXZYCXMUPBBULW-SKNVOMKLSA-N |
| Molecular Formula | C6H10O6 |
D-(-)-Pantolactone, 99%
CAS: 599-04-2 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00005392 InChI Key: SERHXTVXHNVDKA-BYPYZUCNSA-N Synonym: d---pantolactone,r-pantolactone,d-pantolactone,r-pantoyl lactone,d---pantoyl lactone,pantothenic lactone,r-3-hydroxy-4,4-dimethyldihydrofuran-2 3h-one,unii-j288d7o0js,2 3h-furanone, dihydro-3-hydroxy-4,4-dimethyl-, 3r,r---pantolactone PubChem CID: 439368 ChEBI: CHEBI:16719 IUPAC Name: (3R)-3-hydroxy-4,4-dimethyloxolan-2-one SMILES: CC1(COC(=O)C1O)C
| PubChem CID | 439368 |
|---|---|
| CAS | 599-04-2 |
| Molecular Weight (g/mol) | 130.143 |
| ChEBI | CHEBI:16719 |
| MDL Number | MFCD00005392 |
| SMILES | CC1(COC(=O)C1O)C |
| Synonym | d---pantolactone,r-pantolactone,d-pantolactone,r-pantoyl lactone,d---pantoyl lactone,pantothenic lactone,r-3-hydroxy-4,4-dimethyldihydrofuran-2 3h-one,unii-j288d7o0js,2 3h-furanone, dihydro-3-hydroxy-4,4-dimethyl-, 3r,r---pantolactone |
| IUPAC Name | (3R)-3-hydroxy-4,4-dimethyloxolan-2-one |
| InChI Key | SERHXTVXHNVDKA-BYPYZUCNSA-N |
| Molecular Formula | C6H10O3 |
3,3-Dimethylglutaric anhydride, 97%
CAS: 4160-82-1 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00006684 InChI Key: HIJQFTSZBHDYKW-UHFFFAOYSA-N Synonym: 3,3-dimethylglutaric anhydride,2h-pyran-2,6 3h-dione, dihydro-4,4-dimethyl,4,4-dimethyldihydro-2h-pyran-2,6 3h-dione,glutaric anhydride, 3,3-dimethyl,3,3-dimethylglutaricanhydride,glutaric anhydride, beta,beta-dimethyl,acmc-1adve,dihydro-4,4-dimethyl-2h-pyran-2,6 3h-dione,3,3-dimethyladipic anhydride,3,3 dimethylglutaric anhydride PubChem CID: 77813 IUPAC Name: 4,4-dimethyloxane-2,6-dione SMILES: CC1(CC(=O)OC(=O)C1)C
| PubChem CID | 77813 |
|---|---|
| CAS | 4160-82-1 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD00006684 |
| SMILES | CC1(CC(=O)OC(=O)C1)C |
| Synonym | 3,3-dimethylglutaric anhydride,2h-pyran-2,6 3h-dione, dihydro-4,4-dimethyl,4,4-dimethyldihydro-2h-pyran-2,6 3h-dione,glutaric anhydride, 3,3-dimethyl,3,3-dimethylglutaricanhydride,glutaric anhydride, beta,beta-dimethyl,acmc-1adve,dihydro-4,4-dimethyl-2h-pyran-2,6 3h-dione,3,3-dimethyladipic anhydride,3,3 dimethylglutaric anhydride |
| IUPAC Name | 4,4-dimethyloxane-2,6-dione |
| InChI Key | HIJQFTSZBHDYKW-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |
delta-Dodecanolactone, 98%
CAS: 713-95-1 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00006651 InChI Key: QRPLZGZHJABGRS-UHFFFAOYSA-N Synonym: delta-dodecalactone,5-dodecanolide,delta-dodecanolactone,dodecan-5-olide,6-heptyltetrahydro-2h-pyran-2-one,5-dodecalactone,2h-pyran-2-one, 6-heptyltetrahydro,dodecanolide-1,5,5-hydroxydodecanoic acid lactone,n-heptyl-delta-valerolactone PubChem CID: 12844 IUPAC Name: 6-heptyloxan-2-one SMILES: CCCCCCCC1CCCC(=O)O1
| PubChem CID | 12844 |
|---|---|
| CAS | 713-95-1 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00006651 |
| SMILES | CCCCCCCC1CCCC(=O)O1 |
| Synonym | delta-dodecalactone,5-dodecanolide,delta-dodecanolactone,dodecan-5-olide,6-heptyltetrahydro-2h-pyran-2-one,5-dodecalactone,2h-pyran-2-one, 6-heptyltetrahydro,dodecanolide-1,5,5-hydroxydodecanoic acid lactone,n-heptyl-delta-valerolactone |
| IUPAC Name | 6-heptyloxan-2-one |
| InChI Key | QRPLZGZHJABGRS-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
3-Methylglutaric anhydride, 97%
CAS: 4166-53-4 Molecular Formula: C6H8O3 Molecular Weight (g/mol): 128.13 MDL Number: MFCD00006683 InChI Key: MGICRVTUCPFQQZ-UHFFFAOYSA-N Synonym: 3-methylglutaric anhydride,4-methyldihydro-2h-pyran-2,6 3h-dione,3-methylglutaricanhydride,.beta.-methylglutaric anhydride,acmc-1ago6,2h-pyran-2,6 3h-dione, dihydro-4-methyl,3-methyl glutaric anhydride,beta-methylglutaric anhydride,4-methyltetrahydropyran-2,6-dione PubChem CID: 77828 IUPAC Name: 4-methyloxane-2,6-dione SMILES: CC1CC(=O)OC(=O)C1
| PubChem CID | 77828 |
|---|---|
| CAS | 4166-53-4 |
| Molecular Weight (g/mol) | 128.13 |
| MDL Number | MFCD00006683 |
| SMILES | CC1CC(=O)OC(=O)C1 |
| Synonym | 3-methylglutaric anhydride,4-methyldihydro-2h-pyran-2,6 3h-dione,3-methylglutaricanhydride,.beta.-methylglutaric anhydride,acmc-1ago6,2h-pyran-2,6 3h-dione, dihydro-4-methyl,3-methyl glutaric anhydride,beta-methylglutaric anhydride,4-methyltetrahydropyran-2,6-dione |
| IUPAC Name | 4-methyloxane-2,6-dione |
| InChI Key | MGICRVTUCPFQQZ-UHFFFAOYSA-N |
| Molecular Formula | C6H8O3 |
2,3-O-Isopropylidene-D-erythronolactone, 98%, Thermo Scientific Chemicals
CAS: 25581-41-3 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00134440 InChI Key: WHPSMBYLYRPVGU-UHFFFAOYNA-N Synonym: 2,3-o-isopropylidene-d-erythronolactone,--2,3-o-isopropylidene-d-erythronolactone,3ar,6ar-2,2-dimethyldihydrofuro 3,4-d 1,3 dioxol-4 3ah-one,3ar,6ar-2,2-dimethyl-6,6a-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,3ar,6ar-2,2-dimethyl-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,pubchem19725,2,3-o-isopropylidene-d-erythronolactol,d-2,3-o-isopropylidene-erythronic acid,a-lactone,2-o,3-o-isopropylidene-d-erythronic acid gamma-lactone PubChem CID: 386843 IUPAC Name: (3aR,6aR)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-one SMILES: CC1(C)OC2COC(=O)C2O1
| PubChem CID | 386843 |
|---|---|
| CAS | 25581-41-3 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00134440 |
| SMILES | CC1(C)OC2COC(=O)C2O1 |
| Synonym | 2,3-o-isopropylidene-d-erythronolactone,--2,3-o-isopropylidene-d-erythronolactone,3ar,6ar-2,2-dimethyldihydrofuro 3,4-d 1,3 dioxol-4 3ah-one,3ar,6ar-2,2-dimethyl-6,6a-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,3ar,6ar-2,2-dimethyl-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,pubchem19725,2,3-o-isopropylidene-d-erythronolactol,d-2,3-o-isopropylidene-erythronic acid,a-lactone,2-o,3-o-isopropylidene-d-erythronic acid gamma-lactone |
| IUPAC Name | (3aR,6aR)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-one |
| InChI Key | WHPSMBYLYRPVGU-UHFFFAOYNA-N |
| Molecular Formula | C7H10O4 |
(-)-Camphanic acid chloride, 98%
CAS: 39637-74-6 Molecular Formula: C10H13ClO3 Molecular Weight (g/mol): 216.66 MDL Number: MFCD00135626 InChI Key: PAXWODJTHKJQDZ-QVDQXJPCSA-N Synonym: 1s-4,7,7-trimethyl-3-oxo-2-oxabicyclo 2.2.1 heptane-1-carbonyl chloride,--1s,4r-camphanoyl chloride,1s---camphanic acid chloride PubChem CID: 12364938 IUPAC Name: (4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carbonyl chloride SMILES: CC1(C2(CCC1(OC2=O)C(=O)Cl)C)C
| PubChem CID | 12364938 |
|---|---|
| CAS | 39637-74-6 |
| Molecular Weight (g/mol) | 216.66 |
| MDL Number | MFCD00135626 |
| SMILES | CC1(C2(CCC1(OC2=O)C(=O)Cl)C)C |
| Synonym | 1s-4,7,7-trimethyl-3-oxo-2-oxabicyclo 2.2.1 heptane-1-carbonyl chloride,--1s,4r-camphanoyl chloride,1s---camphanic acid chloride |
| IUPAC Name | (4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carbonyl chloride |
| InChI Key | PAXWODJTHKJQDZ-QVDQXJPCSA-N |
| Molecular Formula | C10H13ClO3 |
delta-Decanolactone, 97%
CAS: 705-86-2 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00006649 InChI Key: GHBSPIPJMLAMEP-UHFFFAOYNA-N Synonym: delta-decalactone,6-pentyltetrahydro-2h-pyran-2-one,5-decanolide,decanolide-1,5,5-decalactone,decan-5-olide,amyl-delta-valerolactone,delta-decanolactone,5-pentyl-5-pentanolide,2h-pyran-2-one, tetrahydro-6-pentyl PubChem CID: 12810 ChEBI: CHEBI:87327 IUPAC Name: 6-pentyloxan-2-one SMILES: CCCCCC1CCCC(=O)O1
| PubChem CID | 12810 |
|---|---|
| CAS | 705-86-2 |
| Molecular Weight (g/mol) | 170.25 |
| ChEBI | CHEBI:87327 |
| MDL Number | MFCD00006649 |
| SMILES | CCCCCC1CCCC(=O)O1 |
| Synonym | delta-decalactone,6-pentyltetrahydro-2h-pyran-2-one,5-decanolide,decanolide-1,5,5-decalactone,decan-5-olide,amyl-delta-valerolactone,delta-decanolactone,5-pentyl-5-pentanolide,2h-pyran-2-one, tetrahydro-6-pentyl |
| IUPAC Name | 6-pentyloxan-2-one |
| InChI Key | GHBSPIPJMLAMEP-UHFFFAOYNA-N |
| Molecular Formula | C10H18O2 |
(3aR,4S,5R,6aS)-(-)-Hexahydro-5-hydroxy-4-hydroxymethyl-2H-cyclopenta[b]furan-2-one, 98%
CAS: 32233-40-2 Molecular Formula: C8H12O4 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00075234 InChI Key: VYTZWRCSPHQSFX-GBNDHIKLSA-N Synonym: --corey lactone diol,3ar,4s,5r,6as-5-hydroxy-4-hydroxymethyl hexahydro-2h-cyclopenta b furan-2-one,--corey lactone,corey lactone diol,--corey diol corey lactone,3ar,4s,5r,6as---hexahydro-5-hydroxy-4-hydroxymethyl-2h-cyclopenta b furan-2-one,1s,6s,5r,7r-7-hydroxy-6-hydroxymethyl-2-oxabicyclo 3.3.0 octan-3-one,3ar,4s,5r,6as-hexahydro-5-hydroxy-4-hydroxymethyl-2h-cyclopenta b furan-2-one,3ar,4s,5r,6as-5-hydroxy-4-hydroxymethyl-3,3a,4,5,6,6a-hexahydrocyclopenta b furan-2-one,l-corey lactone PubChem CID: 2724453 IUPAC Name: (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one SMILES: OC[C@H]1[C@H](O)C[C@@H]2OC(=O)C[C@H]12
| PubChem CID | 2724453 |
|---|---|
| CAS | 32233-40-2 |
| Molecular Weight (g/mol) | 172.18 |
| MDL Number | MFCD00075234 |
| SMILES | OC[C@H]1[C@H](O)C[C@@H]2OC(=O)C[C@H]12 |
| Synonym | --corey lactone diol,3ar,4s,5r,6as-5-hydroxy-4-hydroxymethyl hexahydro-2h-cyclopenta b furan-2-one,--corey lactone,corey lactone diol,--corey diol corey lactone,3ar,4s,5r,6as---hexahydro-5-hydroxy-4-hydroxymethyl-2h-cyclopenta b furan-2-one,1s,6s,5r,7r-7-hydroxy-6-hydroxymethyl-2-oxabicyclo 3.3.0 octan-3-one,3ar,4s,5r,6as-hexahydro-5-hydroxy-4-hydroxymethyl-2h-cyclopenta b furan-2-one,3ar,4s,5r,6as-5-hydroxy-4-hydroxymethyl-3,3a,4,5,6,6a-hexahydrocyclopenta b furan-2-one,l-corey lactone |
| IUPAC Name | (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one |
| InChI Key | VYTZWRCSPHQSFX-GBNDHIKLSA-N |
| Molecular Formula | C8H12O4 |
delta-Octanolactone, 97%
CAS: 698-76-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00144051 InChI Key: FYTRVXSHONWYNE-UHFFFAOYSA-N Synonym: delta-octanolactone,delta-octalactone,5-octanolide,5-hydroxyoctanoic acid lactone,2h-pyran-2-one, tetrahydro-6-propyl,5-octalactone,.delta.-octalactone,tetrahydro-6-propyl-2h-pyran-2-one,delta-octanolide,fema no. 3214 PubChem CID: 12777 IUPAC Name: 6-propyloxan-2-one SMILES: CCCC1CCCC(=O)O1
| PubChem CID | 12777 |
|---|---|
| CAS | 698-76-0 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00144051 |
| SMILES | CCCC1CCCC(=O)O1 |
| Synonym | delta-octanolactone,delta-octalactone,5-octanolide,5-hydroxyoctanoic acid lactone,2h-pyran-2-one, tetrahydro-6-propyl,5-octalactone,.delta.-octalactone,tetrahydro-6-propyl-2h-pyran-2-one,delta-octanolide,fema no. 3214 |
| IUPAC Name | 6-propyloxan-2-one |
| InChI Key | FYTRVXSHONWYNE-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
5-Methyl-2-pyridinol, 97%, Thermo Scientific™
CAS: 91914-06-6 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.128 MDL Number: MFCD03092888 InChI Key: SOHMZGMHXUQHGE-UHFFFAOYSA-N Synonym: 2-hydroxy-5-methylpyridine,5-methylpyridin-2-ol,2-hydroxy-5-picoline,5-methyl-2-pyridinol,5-methylpyridin-2 1h-one,5-methyl-2-pyridone,5-methyl-2 1h-pyridinone,2 1h-pyridinone, 5-methyl,2-pyridinol, 5-methyl,6-hydroxy-3-picoline PubChem CID: 70482 IUPAC Name: 5-methyl-1H-pyridin-2-one SMILES: CC1=CNC(=O)C=C1
| PubChem CID | 70482 |
|---|---|
| CAS | 91914-06-6 |
| Molecular Weight (g/mol) | 109.128 |
| MDL Number | MFCD03092888 |
| SMILES | CC1=CNC(=O)C=C1 |
| Synonym | 2-hydroxy-5-methylpyridine,5-methylpyridin-2-ol,2-hydroxy-5-picoline,5-methyl-2-pyridinol,5-methylpyridin-2 1h-one,5-methyl-2-pyridone,5-methyl-2 1h-pyridinone,2 1h-pyridinone, 5-methyl,2-pyridinol, 5-methyl,6-hydroxy-3-picoline |
| IUPAC Name | 5-methyl-1H-pyridin-2-one |
| InChI Key | SOHMZGMHXUQHGE-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO |
2-Hydroxypyridine, 98%
CAS: 142-08-5 Molecular Formula: C5H5NO Molecular Weight (g/mol): 95.10 MDL Number: MFCD00006268 InChI Key: UBQKCCHYAOITMY-UHFFFAOYSA-N Synonym: 2-hydroxypyridine,pyridin-2-ol,2-pyridinol,2-pyridone,pyridin-2 1h-one,2 1h-pyridinone,2-pyridinone,2-oxopyridine,2 1h-pyridone,alpha-pyridone PubChem CID: 8871 ChEBI: CHEBI:16540 SMILES: O=C1NC=CC=C1
| PubChem CID | 8871 |
|---|---|
| CAS | 142-08-5 |
| Molecular Weight (g/mol) | 95.10 |
| ChEBI | CHEBI:16540 |
| MDL Number | MFCD00006268 |
| SMILES | O=C1NC=CC=C1 |
| Synonym | 2-hydroxypyridine,pyridin-2-ol,2-pyridinol,2-pyridone,pyridin-2 1h-one,2 1h-pyridinone,2-pyridinone,2-oxopyridine,2 1h-pyridone,alpha-pyridone |
| InChI Key | UBQKCCHYAOITMY-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO |
2-Methylpyridine-4-carboxylic acid, 97%
CAS: 4021-11-8 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 InChI Key: PMDHIMMPXRSDML-UHFFFAOYSA-N
| CAS | 4021-11-8 |
|---|---|
| Molecular Weight (g/mol) | 137.14 |
| InChI Key | PMDHIMMPXRSDML-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |