Name: Name:4H-1-Benzopyran-2-carboxylic acid, 7-bromo-4-oxo-
Brand: Angene
SKU: AG0009WQ
Rating: 90 (10 reviews)

4H-1-Benzopyran-2-carboxylic acid, 7-bromo-4-oxo-

CAS No.:

113850-96-7

Catalog Number:

AG0009WQ

Molecular Formula:

C10H5BrO4

Molecular Weight:

269.0483

Catalog Number:

AG0009WQ

Chemical Name:

4H-1-Benzopyran-2-carboxylic acid, 7-bromo-4-oxo-

CAS Number:

113850-96-7

Molecular Formula:

C10H5BrO4

Molecular Weight:

269.0483

MDL Number:

MFCD08690667

IUPAC Name:

7-bromo-4-oxochromene-2-carboxylic acid

InChI:

InChI=1S/C10H5BrO4/c11-5-1-2-6-7(12)4-9(10(13)14)15-8(6)3-5/h1-4H,(H,13,14)

InChI Key:

VACMFRPTBQYGGH-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)oc(cc2=O)C(=O)O

Complexity:

336

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.937g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.05g/mol

Monoisotopic Mass:

267.937g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3