Name: Name:7-fluoro-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid
Brand: Angene
SKU: AG01BH0J
Rating: 90 (10 reviews)

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

CAS No.:

1601177-71-2

Catalog Number:

AG01BH0J

Molecular Formula:

C10H7FO4

Molecular Weight:

210.1586

Catalog Number:

AG01BH0J

Chemical Name:

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

CAS Number:

1601177-71-2

Molecular Formula:

C10H7FO4

Molecular Weight:

210.1586

MDL Number:

MFCD26381482

IUPAC Name:

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

InChI:

InChI=1S/C10H7FO4/c11-6-2-1-5-3-8(9(12)13)15-10(14)7(5)4-6/h1-2,4,8H,3H2,(H,12,13)

InChI Key:

GFOSNMAGOIQQRL-UHFFFAOYSA-N

SMILES:

OC(=O)C1OC(=O)c2c(C1)ccc(c2)F

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.16g/mol

Monoisotopic Mass:

210.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5