Name: Name:1-(2,4-DIHYDROXYPHENYL)-2-METHOXYETHAN-1-ONE
Brand: Angene
SKU: AG00EAGP
Rating: 90 (10 reviews)

1-(2,4-DIHYDROXYPHENYL)-2-METHOXYETHAN-1-ONE

CAS No.:

57280-75-8

Catalog Number:

AG00EAGP

Molecular Formula:

C9H10O4

Molecular Weight:

182.1733

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Product Description

Catalog Number:

AG00EAGP

Chemical Name:

1-(2,4-DIHYDROXYPHENYL)-2-METHOXYETHAN-1-ONE

CAS Number:

57280-75-8

Molecular Formula:

C9H10O4

Molecular Weight:

182.1733

MDL Number:

MFCD00100481

IUPAC Name:

1-(2,4-dihydroxyphenyl)-2-methoxyethanone

InChI:

InChI=1S/C9H10O4/c1-13-5-9(12)7-3-2-6(10)4-8(7)11/h2-4,10-11H,5H2,1H3

InChI Key:

LEBDSTPTUMQDQU-UHFFFAOYSA-N

SMILES:

COCC(=O)c1ccc(cc1O)O

Properties

Complexity:

181

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.175g/mol

Monoisotopic Mass:

182.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5

Literature

Title	Journal
Polyketide folding in higher plants: biosynthesis of the phenylanthraquinone knipholone.	The Journal of organic chemistry 20070427

Properties