4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one

C12H10O4 — CID 121001228

IUPAC4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one
SMILESCc1cc(=O)c2c(O)c3c(cc2o1)OCC3
InChIInChI=1S/C12H10O4/c1-6-4-8(13)11-10(16-6)5-9-7(12(11)14)2-3-15-9/h4-5,14H,2-3H2,1H3
InChIKeyGLQRJAYJZOEMBM-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.74
Rot. Bonds

About 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one

4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one (PubChem CID 121001228) has the molecular formula C12H10O4 and a molecular weight of 218.21 g/mol. Its IUPAC name is 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one.

Molecular Properties

Compound Name4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one
PubChem CID121001228
Molecular FormulaC12H10O4
Molecular Weight218.21 g/mol
Exact Mass218.06
IUPAC Name4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one
SMILESCc1cc(=O)c2c(O)c3c(cc2o1)OCC3
InChIInChI=1S/C12H10O4/c1-6-4-8(13)11-10(16-6)5-9-7(12(11)14)2-3-15-9/h4-5,14H,2-3H2,1H3
InChIKeyGLQRJAYJZOEMBM-UHFFFAOYSA-N
XLogP1.74
TPSA59.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,7-dihydroxy-2,6-dimethylchromen-4-one
CID 5036604
(5-hydroxy-2-methyl-4-oxo-6,9-dihydropyrano[3,2-h][1]benzoxepin-8-yl)methyl acetate
CID 162675454
5-hydroxy-2,6-dimethylchromen-4-one
CID 170989896
5,6-dihydroxy-7-methoxy-2-methylchromen-4-one
CID 52918156
[(3S)-5-hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydropyrano[3,2-g]chromen-3-yl] acetate
CID 5315865
5-hydroxy-2-methyl-8H-cyclopenta[g]chromen-4-one
CID 130193601
5-hydroxy-8-methylpyrano[3,2-g]chromene-2,6-dione
CID 42631475
(5-hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydropyrano[3,2-g]chromen-3-yl) (Z)-3-methylsulfanylprop-2-enoate
CID 44660831
4-hydroxy-7-methyl-2-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one
CID 23899994
(2R)-4-hydroxy-7-methyl-2-[2-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one
CID 38347375
(2R)-4-hydroxy-7-methyl-2-[2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one
CID 124899856
5-hydroxy-8-(4-hydroxyphenyl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one
CID 15389226

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one?
The IUPAC name of 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one (CID 121001228) is 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one.
What is the SMILES notation for 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one?
The canonical SMILES for 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one is Cc1cc(=O)c2c(O)c3c(cc2o1)OCC3.
What is the InChIKey of 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one?
The InChIKey is GLQRJAYJZOEMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O4/c1-6-4-8(13)11-10(16-6)5-9-7(12(11)14)2-3-15-9/h4-5,14H,2-3H2,1H3.
What are the key properties of 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one?
4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one has a molecular weight of 218.21 g/mol, XLogP of 1.74, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one is sourced from PubChem (CID 121001228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).