Name: Name:2H-1-Benzopyran-3-carboxylicacid, 7-hydroxy-2-oxo-, methyl ester
Brand: Angene
SKU: AG004JHR
Rating: 90 (10 reviews)

2H-1-Benzopyran-3-carboxylicacid, 7-hydroxy-2-oxo-, methyl ester

CAS No.:

86788-49-0

Catalog Number:

AG004JHR

Molecular Formula:

C11H8O5

Molecular Weight:

220.1782

Catalog Number:

AG004JHR

Chemical Name:

2H-1-Benzopyran-3-carboxylicacid, 7-hydroxy-2-oxo-, methyl ester

CAS Number:

86788-49-0

Molecular Formula:

C11H8O5

Molecular Weight:

220.1782

MDL Number:

MFCD00488484

IUPAC Name:

methyl 7-hydroxy-2-oxochromene-3-carboxylate

InChI:

InChI=1S/C11H8O5/c1-15-10(13)8-4-6-2-3-7(12)5-9(6)16-11(8)14/h2-5,12H,1H3

InChI Key:

UDRWUSXZHQTTEN-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2ccc(cc2oc1=O)O

Complexity:

346

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.18g/mol

Monoisotopic Mass:

220.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6