Name: Name:1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
Brand: Angene
SKU: AG01EKQS
Rating: 90 (10 reviews)

1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid

CAS No.:

52465-55-1

Catalog Number:

AG01EKQS

Molecular Formula:

C10H8O4

Molecular Weight:

192.1681

Catalog Number:

AG01EKQS

Chemical Name:

1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid

CAS Number:

52465-55-1

Molecular Formula:

C10H8O4

Molecular Weight:

192.1681

MDL Number:

MFCD31691136

IUPAC Name:

1-oxo-3,4-dihydroisochromene-7-carboxylic acid

InChI:

InChI=1S/C10H8O4/c11-9(12)7-2-1-6-3-4-14-10(13)8(6)5-7/h1-2,5H,3-4H2,(H,11,12)

InChI Key:

MOPVVNQYYAUTKQ-UHFFFAOYSA-N

SMILES:

O=C1OCCc2c1cc(cc2)C(=O)O

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.17g/mol

Monoisotopic Mass:

192.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3