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111050-72-7

111050-72-7 structural image
Product Name: 1-((3,5-dichloro)-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone
Formula: C13H16Cl2O4
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COMPUTED DESCRIPTORS

Molecular Weight 307.17 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 306.0425644 g/mol
Monoisotopic Mass 306.0425644 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 284
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one is a differentiation-inducing factor that is hexaphenone bearing two chloro substituents at positions 3 and 5, two hydroxy substituents at positions 2 and 6 as well as a single methoxy substituent at position 4. A secreted, chlorinated molecule that controls cell fate during development of Dictyostelium cells. It has a role as a eukaryotic metabolite and a signalling molecule. It is a monomethoxybenzene, a member of resorcinols, a differentiation-inducing factor and a dichlorobenzene. It is functionally related to a (3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one. It is a conjugate acid of a 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one(1-).