Name: Name:2H-1-Benzopyran-2-one, 4-hydroxy-6-methoxy-
Brand: Angene
SKU: AG0010S3
Rating: 90 (10 reviews)

2H-1-Benzopyran-2-one, 4-hydroxy-6-methoxy-

CAS No.:

13252-84-1

Catalog Number:

AG0010S3

Molecular Formula:

C10H8O4

Molecular Weight:

192.1681

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Product Description

Catalog Number:

AG0010S3

Chemical Name:

2H-1-Benzopyran-2-one, 4-hydroxy-6-methoxy-

CAS Number:

13252-84-1

Molecular Formula:

C10H8O4

Molecular Weight:

192.1681

MDL Number:

MFCD00463526

IUPAC Name:

4-hydroxy-6-methoxychromen-2-one

InChI:

InChI=1S/C10H8O4/c1-13-6-2-3-9-7(4-6)8(11)5-10(12)14-9/h2-5,11H,1H3

InChI Key:

KFXXRRQBVLINPH-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)c(O)cc(=O)o2

Properties

Complexity:

271

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:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties