Name: Name:2H-1-Benzopyran-7-carboxylic acid, 3,4-dihydro-4-oxo-, Methyl ester
Brand: Angene
SKU: AG00CACO
Rating: 90 (10 reviews)

2H-1-Benzopyran-7-carboxylic acid, 3,4-dihydro-4-oxo-, Methyl ester

CAS No.:

41118-21-2

Catalog Number:

AG00CACO

Molecular Formula:

C11H10O4

Molecular Weight:

206.1947

Catalog Number:

AG00CACO

Chemical Name:

2H-1-Benzopyran-7-carboxylic acid, 3,4-dihydro-4-oxo-, Methyl ester

CAS Number:

41118-21-2

Molecular Formula:

C11H10O4

Molecular Weight:

206.1947

MDL Number:

MFCD00150335

IUPAC Name:

methyl 4-oxo-2,3-dihydrochromene-7-carboxylate

InChI:

InChI=1S/C11H10O4/c1-14-11(13)7-2-3-8-9(12)4-5-15-10(8)6-7/h2-3,6H,4-5H2,1H3

InChI Key:

VHVGLYNWKHXGJG-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc2c(c1)OCCC2=O

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

206.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

206.197g/mol

Monoisotopic Mass:

206.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2