Oxacyclic compounds

Organic heterocyclic compounds that contain one or more oxygen atoms either within the ring's structure or linked to the ring.

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3-Methylphthalic anhydride, 96%, Thermo Scientific Chemicals

CAS: 4792-30-7 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00047316 InChI Key: TWWAWPHAOPTQEU-UHFFFAOYSA-N Synonym: 3-methylphthalic anhydride,4-methylisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-methyl,3-methyl phthalic anhydride,methylphthalic anhydride,phthalic anhydride, 3-methyl,2,3-toluenedicarboxylic anhydride,1,3-isobenzofurandione, methyl,4-methyl-1,3-dihydro-2-benzofuran-1,3-dione,acmc-1arrb PubChem CID: 98500 IUPAC Name: 4-methyl-2-benzofuran-1,3-dione SMILES: CC1=CC=CC2=C1C(=O)OC2=O

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Specifications

PubChem CID	98500
CAS	4792-30-7
Molecular Weight (g/mol)	162.14
MDL Number	MFCD00047316
SMILES	CC1=CC=CC2=C1C(=O)OC2=O
Synonym	3-methylphthalic anhydride,4-methylisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-methyl,3-methyl phthalic anhydride,methylphthalic anhydride,phthalic anhydride, 3-methyl,2,3-toluenedicarboxylic anhydride,1,3-isobenzofurandione, methyl,4-methyl-1,3-dihydro-2-benzofuran-1,3-dione,acmc-1arrb
IUPAC Name	4-methyl-2-benzofuran-1,3-dione
InChI Key	TWWAWPHAOPTQEU-UHFFFAOYSA-N
Molecular Formula	C9H6O3

4-Oxo-4H-1-benzopyran-2-carboxylic acid, 97%

CAS: 4940-39-0 Molecular Formula: C₁₀H₆O₄ Molecular Weight (g/mol): 190.15 MDL Number: MFCD00006838 InChI Key: RVMGXWBCQGAWBR-UHFFFAOYSA-N Synonym: chromocarb,chromone-2-carboxylic acid,4-oxo-4h-chromene-2-carboxylic acid,4-oxo-4h-1-benzopyran-2-carboxylic acid,atremon,chromonecarboxylic acid,lp-1,chromocarb inn:dcf,2-chromonecarboxylic acid,chromocarbe inn-french PubChem CID: 2741 IUPAC Name: 4-oxochromene-2-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)O

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Specifications

PubChem CID	2741
CAS	4940-39-0
Molecular Weight (g/mol)	190.15
MDL Number	MFCD00006838
SMILES	C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)O
Synonym	chromocarb,chromone-2-carboxylic acid,4-oxo-4h-chromene-2-carboxylic acid,4-oxo-4h-1-benzopyran-2-carboxylic acid,atremon,chromonecarboxylic acid,lp-1,chromocarb inn:dcf,2-chromonecarboxylic acid,chromocarbe inn-french
IUPAC Name	4-oxochromene-2-carboxylic acid
InChI Key	RVMGXWBCQGAWBR-UHFFFAOYSA-N
Molecular Formula	C₁₀H₆O₄

Citraconic anhydride, 98%

CAS: 616-02-4 Molecular Formula: C₅H₄O₃ Molecular Weight (g/mol): 112.08 MDL Number: MFCD00005522 InChI Key: AYKYXWQEBUNJCN-UHFFFAOYSA-N Synonym: citraconic anhydride,2,5-furandione, 3-methyl,2-methylmaleic anhydride,methylmaleic anhydride,3-methylmaleic anhydride,citraconic acid anhydride,monomethylmaleic anhydride,maleic anhydride, methyl,2-methylmaleicanhydride,unii-105np7pmxx PubChem CID: 12012 IUPAC Name: 3-methylfuran-2,5-dione SMILES: CC1=CC(=O)OC1=O

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Specifications

PubChem CID	12012
CAS	616-02-4
Molecular Weight (g/mol)	112.08
MDL Number	MFCD00005522
SMILES	CC1=CC(=O)OC1=O
Synonym	citraconic anhydride,2,5-furandione, 3-methyl,2-methylmaleic anhydride,methylmaleic anhydride,3-methylmaleic anhydride,citraconic acid anhydride,monomethylmaleic anhydride,maleic anhydride, methyl,2-methylmaleicanhydride,unii-105np7pmxx
IUPAC Name	3-methylfuran-2,5-dione
InChI Key	AYKYXWQEBUNJCN-UHFFFAOYSA-N
Molecular Formula	C₅H₄O₃

5-Aminophthalide, 97%, Thermo Scientific Chemicals

CAS: 65399-05-5 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00778315 InChI Key: ISMUWQMUWFPFBZ-UHFFFAOYSA-N Synonym: 5-aminophthalide,5-aminoisobenzofuran-1 3h-one,5-amino-3h-isobenzofuran-1-one,5-amino-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 5-amino,5-amino-1 3h-isobenzofuranone,5-amino-1,3-dihydro-2-benzofuran-1-one,5-amino-3-hydroisobenzofuran-1-one,5-aminophthliade,5-amino-phthalide PubChem CID: 720669 IUPAC Name: 5-amino-3H-2-benzofuran-1-one SMILES: C1C2=C(C=CC(=C2)N)C(=O)O1

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Specifications

PubChem CID	720669
CAS	65399-05-5
Molecular Weight (g/mol)	149.149
MDL Number	MFCD00778315
SMILES	C1C2=C(C=CC(=C2)N)C(=O)O1
Synonym	5-aminophthalide,5-aminoisobenzofuran-1 3h-one,5-amino-3h-isobenzofuran-1-one,5-amino-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 5-amino,5-amino-1 3h-isobenzofuranone,5-amino-1,3-dihydro-2-benzofuran-1-one,5-amino-3-hydroisobenzofuran-1-one,5-aminophthliade,5-amino-phthalide
IUPAC Name	5-amino-3H-2-benzofuran-1-one
InChI Key	ISMUWQMUWFPFBZ-UHFFFAOYSA-N
Molecular Formula	C8H7NO2

2,2,4-Trimethyl-1,3-dioxolane, 99%

CAS: 1193-11-9 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00090841 InChI Key: ALTFLAPROMVXNX-UHFFFAOYNA-N PubChem CID: 62384 IUPAC Name: 2,2,4-trimethyl-1,3-dioxolane SMILES: CC1COC(C)(C)O1

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Specifications

PubChem CID	62384
CAS	1193-11-9
Molecular Weight (g/mol)	116.16
MDL Number	MFCD00090841
SMILES	CC1COC(C)(C)O1
IUPAC Name	2,2,4-trimethyl-1,3-dioxolane
InChI Key	ALTFLAPROMVXNX-UHFFFAOYNA-N
Molecular Formula	C6H12O2

(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde, 97%

CAS: 15186-48-8 Molecular Formula: C₆H₁₀O₃ Molecular Weight (g/mol): 130.14 MDL Number: MFCD00269682 InChI Key: YSGPYVWACGYQDJ-YFKPBYRVSA-N Synonym: r-+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,4r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-+-glyceraldehyde acetonide,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, r,acetone d-glyceraldehyde,+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, 4r,4r-2,2-dimethyl-1,3-dioxolan-4-carbaldehyd,pubchem5767 PubChem CID: 259712 IUPAC Name: (4R)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde SMILES: CC1(OCC(O1)C=O)C

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Specifications

PubChem CID	259712
CAS	15186-48-8
Molecular Weight (g/mol)	130.14
MDL Number	MFCD00269682
SMILES	CC1(OCC(O1)C=O)C
Synonym	r-+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,4r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-+-glyceraldehyde acetonide,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, r,acetone d-glyceraldehyde,+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, 4r,4r-2,2-dimethyl-1,3-dioxolan-4-carbaldehyd,pubchem5767
IUPAC Name	(4R)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
InChI Key	YSGPYVWACGYQDJ-YFKPBYRVSA-N
Molecular Formula	C₆H₁₀O₃

4,5-Dichlorophthalic anhydride, 98%

CAS: 942-06-3 Molecular Formula: C8H2Cl2O3 Molecular Weight (g/mol): 217.00 MDL Number: MFCD00075034 InChI Key: ULSOWUBMELTORB-UHFFFAOYSA-N Synonym: 4,5-dichlorophthalic anhydride,5,6-dichloroisobenzofuran-1,3-dione,4,5-dichlorophthalicanhydride,1,3-isobenzofurandione, 5,6-dichloro,5,6-dichloro-1,3-dihydro-2-benzofuran-1,3-dione,5,6-dichloro-1,3-dihydroisobenzofuran-1,3-dione,5,6-dichlor-2-benzofuran-1,3-dion,pubchem16761,acmc-209rqk,4,5-dichlorophalic anhydride PubChem CID: 70334 IUPAC Name: 5,6-dichloro-2-benzofuran-1,3-dione SMILES: ClC1=CC2=C(C=C1Cl)C(=O)OC2=O

Pricing and Availability
Specifications

PubChem CID	70334
CAS	942-06-3
Molecular Weight (g/mol)	217.00
MDL Number	MFCD00075034
SMILES	ClC1=CC2=C(C=C1Cl)C(=O)OC2=O
Synonym	4,5-dichlorophthalic anhydride,5,6-dichloroisobenzofuran-1,3-dione,4,5-dichlorophthalicanhydride,1,3-isobenzofurandione, 5,6-dichloro,5,6-dichloro-1,3-dihydro-2-benzofuran-1,3-dione,5,6-dichloro-1,3-dihydroisobenzofuran-1,3-dione,5,6-dichlor-2-benzofuran-1,3-dion,pubchem16761,acmc-209rqk,4,5-dichlorophalic anhydride
IUPAC Name	5,6-dichloro-2-benzofuran-1,3-dione
InChI Key	ULSOWUBMELTORB-UHFFFAOYSA-N
Molecular Formula	C8H2Cl2O3

4,6-Dimethyl-2-pyrone, 98%

CAS: 675-09-2 Molecular Formula: C₇H₈O₂ Molecular Weight (g/mol): 124.14 MDL Number: MFCD00075555 Synonym: 4,6-dimethyl-2-pyrone,4,6-dimethyl-2h-pyran-2-one,mesitene lactone,4,6-dimethylcoumalin,2h-pyran-2-one, 4,6-dimethyl,4,6-dimethyl-alpha-pyrone,4,6-dimethyl-pyran-2-one,2,4-dimethyl-alpha-pyrone,2,4-dimethyl-.alpha.-pyrone,4,6-dimethyl-.alpha.-pyrone

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Specifications

CAS	675-09-2
Molecular Weight (g/mol)	124.14
MDL Number	MFCD00075555
Synonym	4,6-dimethyl-2-pyrone,4,6-dimethyl-2h-pyran-2-one,mesitene lactone,4,6-dimethylcoumalin,2h-pyran-2-one, 4,6-dimethyl,4,6-dimethyl-alpha-pyrone,4,6-dimethyl-pyran-2-one,2,4-dimethyl-alpha-pyrone,2,4-dimethyl-.alpha.-pyrone,4,6-dimethyl-.alpha.-pyrone
Molecular Formula	C₇H₈O₂

2,2-Dimethyl-1,3-dioxolane, 98+%

CAS: 2916-31-6 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00014106 InChI Key: SIJBDWPVNAYVGY-UHFFFAOYSA-N PubChem CID: 76209 IUPAC Name: 2,2-dimethyl-1,3-dioxolane SMILES: CC1(C)OCCO1

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Specifications

PubChem CID	76209
CAS	2916-31-6
Molecular Weight (g/mol)	102.13
MDL Number	MFCD00014106
SMILES	CC1(C)OCCO1
IUPAC Name	2,2-dimethyl-1,3-dioxolane
InChI Key	SIJBDWPVNAYVGY-UHFFFAOYSA-N
Molecular Formula	C5H10O2

4,5',8-Trimethylpsoralen, 97.5%

CAS: 3902-71-4 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.25 MDL Number: MFCD00005010 InChI Key: FMHHVULEAZTJMA-UHFFFAOYSA-N Synonym: trioxsalen,trioxysalen,trisoralen,trimethylpsoralen,4,5',8-trimethylpsoralen,elder 8011,trioxisaleno,trioxysalene,trioxysalenum,2',4,8-trimethylpsoralen PubChem CID: 5585 ChEBI: CHEBI:28329 IUPAC Name: 2,5,9-trimethylfuro[3,2-g]chromen-7-one SMILES: CC1=CC2=CC3=C(OC(=O)C=C3C)C(C)=C2O1

Pricing and Availability
Specifications

PubChem CID	5585
CAS	3902-71-4
Molecular Weight (g/mol)	228.25
ChEBI	CHEBI:28329
MDL Number	MFCD00005010
SMILES	CC1=CC2=CC3=C(OC(=O)C=C3C)C(C)=C2O1
Synonym	trioxsalen,trioxysalen,trisoralen,trimethylpsoralen,4,5',8-trimethylpsoralen,elder 8011,trioxisaleno,trioxysalene,trioxysalenum,2',4,8-trimethylpsoralen
IUPAC Name	2,5,9-trimethylfuro[3,2-g]chromen-7-one
InChI Key	FMHHVULEAZTJMA-UHFFFAOYSA-N
Molecular Formula	C14H12O3

3,4-Dihydro-2H-pyran, 99%

CAS: 110-87-2 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00006558 InChI Key: BUDQDWGNQVEFAC-UHFFFAOYSA-N Synonym: dihydropyran,3,4-dihydropyran,2,3-dihydropyran,2h-3,4-dihydropyran,2,3-dihydro-4h-pyran,dihydro-2h-pyran,2h-pyran, dihydro,2h-pyran, 3,4-dihydro,5,6-dihydro-4h-pyran,dihydropyrane PubChem CID: 8080 IUPAC Name: 3,4-dihydro-2H-pyran SMILES: C1CC=COC1

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Specifications

PubChem CID	8080
CAS	110-87-2
Molecular Weight (g/mol)	84.118
MDL Number	MFCD00006558
SMILES	C1CC=COC1
Synonym	dihydropyran,3,4-dihydropyran,2,3-dihydropyran,2h-3,4-dihydropyran,2,3-dihydro-4h-pyran,dihydro-2h-pyran,2h-pyran, dihydro,2h-pyran, 3,4-dihydro,5,6-dihydro-4h-pyran,dihydropyrane
IUPAC Name	3,4-dihydro-2H-pyran
InChI Key	BUDQDWGNQVEFAC-UHFFFAOYSA-N
Molecular Formula	C5H8O

Xanthydrol, 98+%

CAS: 90-46-0 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00005057 InChI Key: JFRMYMMIJXLMBB-UHFFFAOYSA-N Synonym: 9-hydroxyxanthene,xanthydrol,xanthanol,9-xanthydrol,xanthen-9-ol,xanthene, hydroxy,9-xanthenol,ccris 1640,unii-7131m69ikf,xanthrol PubChem CID: 72861 IUPAC Name: 9H-xanthen-9-ol SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)O

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Specifications

PubChem CID	72861
CAS	90-46-0
Molecular Weight (g/mol)	198.221
MDL Number	MFCD00005057
SMILES	C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)O
Synonym	9-hydroxyxanthene,xanthydrol,xanthanol,9-xanthydrol,xanthen-9-ol,xanthene, hydroxy,9-xanthenol,ccris 1640,unii-7131m69ikf,xanthrol
IUPAC Name	9H-xanthen-9-ol
InChI Key	JFRMYMMIJXLMBB-UHFFFAOYSA-N
Molecular Formula	C13H10O2

2-Methylbenzofuran, 96%

CAS: 4265-25-2 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.16 MDL Number: MFCD00005850 InChI Key: GBGPVUAOTCNZPT-UHFFFAOYSA-N Synonym: 2-methylbenzofuran,benzofuran, 2-methyl,2-methylcumarone,2-methylbenzo b furan,2-methyl benzofuran,unii-8x3183bz3x,methylbenzofuran,methyl benzoxole,2-methyl-benzofuran,# PubChem CID: 20263 IUPAC Name: 2-methyl-1-benzofuran SMILES: CC1=CC2=CC=CC=C2O1

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Specifications

PubChem CID	20263
CAS	4265-25-2
Molecular Weight (g/mol)	132.16
MDL Number	MFCD00005850
SMILES	CC1=CC2=CC=CC=C2O1
Synonym	2-methylbenzofuran,benzofuran, 2-methyl,2-methylcumarone,2-methylbenzo b furan,2-methyl benzofuran,unii-8x3183bz3x,methylbenzofuran,methyl benzoxole,2-methyl-benzofuran,#
IUPAC Name	2-methyl-1-benzofuran
InChI Key	GBGPVUAOTCNZPT-UHFFFAOYSA-N
Molecular Formula	C9H8O

Ethyl 3-(2-furyl)propionate, 98%

CAS: 10031-90-0 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.192 MDL Number: MFCD00036496 InChI Key: OWIWZQQFSTZZIG-UHFFFAOYSA-N Synonym: ethyl 3-2-furyl propionate,ethyl 2-furanpropionate,2-furanpropanoic acid, ethyl ester,ethyl 3-2-furyl propanoate,ethyl furfhydracrylate,ethyl furfurylacetate,ethyl 3-furan-2-yl propanoate,2-furanpropionic acid, ethyl ester,ethyl 2-furanpropanoate,ethyl furan-2-propionate PubChem CID: 61450 IUPAC Name: ethyl 3-(furan-2-yl)propanoate SMILES: CCOC(=O)CCC1=CC=CO1

Pricing and Availability
Specifications

PubChem CID	61450
CAS	10031-90-0
Molecular Weight (g/mol)	168.192
MDL Number	MFCD00036496
SMILES	CCOC(=O)CCC1=CC=CO1
Synonym	ethyl 3-2-furyl propionate,ethyl 2-furanpropionate,2-furanpropanoic acid, ethyl ester,ethyl 3-2-furyl propanoate,ethyl furfhydracrylate,ethyl furfurylacetate,ethyl 3-furan-2-yl propanoate,2-furanpropionic acid, ethyl ester,ethyl 2-furanpropanoate,ethyl furan-2-propionate
IUPAC Name	ethyl 3-(furan-2-yl)propanoate
InChI Key	OWIWZQQFSTZZIG-UHFFFAOYSA-N
Molecular Formula	C9H12O3

4-Methylphthalic anhydride, 96%

CAS: 19438-61-0 Molecular Formula: C₉H₆O₃ Molecular Weight (g/mol): 162.14 MDL Number: MFCD00041856 InChI Key: ZOXBWJMCXHTKNU-UHFFFAOYSA-N Synonym: 4-methylphthalic anhydride,5-methylisobenzofuran-1,3-dione,1,3-isobenzofurandione, 5-methyl,unii-2p2740fpck,phthalic anhydride, 4-methyl,dsstox_cid_7805,5-methyl-1,3-dihydro-2-benzofuran-1,3-dione,dsstox_rid_78575,dsstox_gsid_27805,4methylphthalic anhydride PubChem CID: 88069 IUPAC Name: 5-methyl-2-benzofuran-1,3-dione SMILES: CC1=CC2=C(C=C1)C(=O)OC2=O

Pricing and Availability
Specifications

PubChem CID	88069
CAS	19438-61-0
Molecular Weight (g/mol)	162.14
MDL Number	MFCD00041856
SMILES	CC1=CC2=C(C=C1)C(=O)OC2=O
Synonym	4-methylphthalic anhydride,5-methylisobenzofuran-1,3-dione,1,3-isobenzofurandione, 5-methyl,unii-2p2740fpck,phthalic anhydride, 4-methyl,dsstox_cid_7805,5-methyl-1,3-dihydro-2-benzofuran-1,3-dione,dsstox_rid_78575,dsstox_gsid_27805,4methylphthalic anhydride
IUPAC Name	5-methyl-2-benzofuran-1,3-dione
InChI Key	ZOXBWJMCXHTKNU-UHFFFAOYSA-N
Molecular Formula	C₉H₆O₃

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