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Isobenzofurans

Organic heterocyclic compounds that consist of a furan ring and a benzene ring fused together to form a bicycle; they are isomers of benzofuran.

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1

Thermo Scientific Chemicals Fluorescein

CAS: 2321-07-5 Molecular Formula: C20H12O5 Molecular Weight (g/mol): 332.31 MDL Number: MFCD00005050 InChI Key: GNBHRKFJIUUOQI-UHFFFAOYSA-N Synonym: fluorescein,solvent yellow 94,resorcinolphthalein,yellow fluorescein,3,6-fluorandiol,d and c yellow no. 7,fluoresceine,japan yellow 201,c.i. solvent yellow 94,d&c yellow no. 7 PubChem CID: 16850 ChEBI: CHEBI:31624 IUPAC Name: 3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one SMILES: C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O

EDGE
PubChem CID 16850
CAS 2321-07-5
Molecular Weight (g/mol) 332.31
ChEBI CHEBI:31624
MDL Number MFCD00005050
SMILES C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O
Synonym fluorescein,solvent yellow 94,resorcinolphthalein,yellow fluorescein,3,6-fluorandiol,d and c yellow no. 7,fluoresceine,japan yellow 201,c.i. solvent yellow 94,d&c yellow no. 7
IUPAC Name 3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
InChI Key GNBHRKFJIUUOQI-UHFFFAOYSA-N
Molecular Formula C20H12O5
2

Thermo Scientific Chemicals 4',5'-Dibromofluorescein, ca. 95% dye content

CAS: 596-03-2 Molecular Formula: C20H10Br2O5 Molecular Weight (g/mol): 490.103 MDL Number: MFCD00005042 InChI Key: ZDTNHRWWURISAA-UHFFFAOYSA-N Synonym: 4',5'-dibromofluorescein,solvent red 72,eosinic acid,japan orange 201,FD&C orange no. 5,c.i. solvent red 72,4',5'-dibromofluororescein,4,5-dibromofluorescein,d & c orange no. 5,japan orange no. 201 PubChem CID: 11689 IUPAC Name: 4',5'-dibromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one SMILES: C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Br)OC5=C3C=CC(=C5Br)O

PubChem CID 11689
CAS 596-03-2
Molecular Weight (g/mol) 490.103
MDL Number MFCD00005042
SMILES C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Br)OC5=C3C=CC(=C5Br)O
Synonym 4',5'-dibromofluorescein,solvent red 72,eosinic acid,japan orange 201,FD&C orange no. 5,c.i. solvent red 72,4',5'-dibromofluororescein,4,5-dibromofluorescein,d & c orange no. 5,japan orange no. 201
IUPAC Name 4',5'-dibromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
InChI Key ZDTNHRWWURISAA-UHFFFAOYSA-N
Molecular Formula C20H10Br2O5
3

4',5'-Dibromofluorescein, Thermo Scientific™

CAS: 596-03-2 Molecular Formula: C20H10Br2O5 Molecular Weight (g/mol): 490.11 InChI Key: ZDTNHRWWURISAA-UHFFFAOYSA-N Synonym: 4',5'-dibromofluorescein,solvent red 72,eosinic acid,japan orange 201,FD&C orange no. 5,c.i. solvent red 72,4',5'-dibromofluororescein,4,5-dibromofluorescein,d & c orange no. 5,japan orange no. 201 PubChem CID: 11689 IUPAC Name: 4',5'-dibromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one SMILES: C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Br)OC5=C3C=CC(=C5Br)O

PubChem CID 11689
CAS 596-03-2
Molecular Weight (g/mol) 490.11
SMILES C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Br)OC5=C3C=CC(=C5Br)O
Synonym 4',5'-dibromofluorescein,solvent red 72,eosinic acid,japan orange 201,FD&C orange no. 5,c.i. solvent red 72,4',5'-dibromofluororescein,4,5-dibromofluorescein,d & c orange no. 5,japan orange no. 201
IUPAC Name 4',5'-dibromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
InChI Key ZDTNHRWWURISAA-UHFFFAOYSA-N
Molecular Formula C20H10Br2O5
4
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1,3-Diphenylisobenzofuran, 97%

CAS: 5471-63-6 Molecular Formula: C20H14O Molecular Weight (g/mol): 270.32 MDL Number: MFCD00005931 InChI Key: ZKSVYBRJSMBDMV-UHFFFAOYSA-N Synonym: 1,3-diphenylisobenzofuran,diphenylisobenzofuran,isobenzofuran, 1,3-diphenyl,1,3 diphenylisobenzofuran,2,5-diphenyl-3,4-benzofuran,acmc-209lj9,1,3-diphenylbenzo c furan,1,3-diphenylisobenzo b furan,1,3-di phenyl-2-benzofuran,# PubChem CID: 21649 IUPAC Name: 1,3-diphenyl-2-benzofuran SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=C(O2)C4=CC=CC=C4

PubChem CID 21649
CAS 5471-63-6
Molecular Weight (g/mol) 270.32
MDL Number MFCD00005931
SMILES C1=CC=C(C=C1)C2=C3C=CC=CC3=C(O2)C4=CC=CC=C4
Synonym 1,3-diphenylisobenzofuran,diphenylisobenzofuran,isobenzofuran, 1,3-diphenyl,1,3 diphenylisobenzofuran,2,5-diphenyl-3,4-benzofuran,acmc-209lj9,1,3-diphenylbenzo c furan,1,3-diphenylisobenzo b furan,1,3-di phenyl-2-benzofuran,#
IUPAC Name 1,3-diphenyl-2-benzofuran
InChI Key ZKSVYBRJSMBDMV-UHFFFAOYSA-N
Molecular Formula C20H14O
5
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Hexahydro-4-methylphthalic anhydride, 98%, mixture of cis and trans

CAS: 19438-60-9 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00005927 InChI Key: FKBMTBAXDISZGN-UHFFFAOYSA-N Synonym: hexahydro-4-methylphthalic anhydride,4-methylhexahydrophthalic anhydride,5-methylhexahydroisobenzofuran-1,3-dione,4-methyl-1,2-cyclohexanedicarboxylic anhydride,1,3-isobenzofurandione, hexahydro-5-methyl,1,3-isobenzofurandione, hexahydromethyl,4-methylcyclohexane-1,2-dicarboxylic anhydride,5-methylhexahydrophthalic anhydride,5-methyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-dione,4-methyl-1,2-cyclohexanedicarboxylic anhydride, mixture of isomers PubChem CID: 86876 IUPAC Name: 5-methyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione SMILES: CC1CCC2C(C1)C(=O)OC2=O

PubChem CID 86876
CAS 19438-60-9
Molecular Weight (g/mol) 168.19
MDL Number MFCD00005927
SMILES CC1CCC2C(C1)C(=O)OC2=O
Synonym hexahydro-4-methylphthalic anhydride,4-methylhexahydrophthalic anhydride,5-methylhexahydroisobenzofuran-1,3-dione,4-methyl-1,2-cyclohexanedicarboxylic anhydride,1,3-isobenzofurandione, hexahydro-5-methyl,1,3-isobenzofurandione, hexahydromethyl,4-methylcyclohexane-1,2-dicarboxylic anhydride,5-methylhexahydrophthalic anhydride,5-methyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-dione,4-methyl-1,2-cyclohexanedicarboxylic anhydride, mixture of isomers
IUPAC Name 5-methyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione
InChI Key FKBMTBAXDISZGN-UHFFFAOYSA-N
Molecular Formula C9H12O3
6
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cis-1,2-Cyclohexanedicarboxylic anhydride, 99%

CAS: 13149-00-3 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00005926 InChI Key: MUTGBJKUEZFXGO-OLQVQODUSA-N Synonym: cis-hexahydroisobenzofuran-1,3-dione,cis-1,2-cyclohexanedicarboxylic anhydride,cis-hexahydrophthalic anhydride,unii-b52z7tnv87,cis-cyclohexane-1,2-dicarboxylic anhydride,hexahydrophthalic anhydride, cis,3ar,7as-hexahydro-2-benzofuran-1,3-dione,1,3-isobenzofurandione, hexahydro-, 3ar,7as-rel,3ar,7as-hexahydroisobenzofuran-1,3-dione,1,3-isobenzofurandione, hexahydro-, cis PubChem CID: 641660 IUPAC Name: (3aS,7aR)-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione SMILES: C1CCC2C(C1)C(=O)OC2=O

PubChem CID 641660
CAS 13149-00-3
Molecular Weight (g/mol) 154.17
MDL Number MFCD00005926
SMILES C1CCC2C(C1)C(=O)OC2=O
Synonym cis-hexahydroisobenzofuran-1,3-dione,cis-1,2-cyclohexanedicarboxylic anhydride,cis-hexahydrophthalic anhydride,unii-b52z7tnv87,cis-cyclohexane-1,2-dicarboxylic anhydride,hexahydrophthalic anhydride, cis,3ar,7as-hexahydro-2-benzofuran-1,3-dione,1,3-isobenzofurandione, hexahydro-, 3ar,7as-rel,3ar,7as-hexahydroisobenzofuran-1,3-dione,1,3-isobenzofurandione, hexahydro-, cis
IUPAC Name (3aS,7aR)-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione
InChI Key MUTGBJKUEZFXGO-OLQVQODUSA-N
Molecular Formula C8H10O3