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1086-80-2

1086-80-2 structural image
Product Name: LUMICHROME
Formula: C12H10N4O2
Synonyms: 7,8-Dimethylalloxazine
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CHEMICAL AND PHYSICAL PROPERTIES

Melting Point >300 °C
Collision Cross Section 153.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 242.23 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 242.08037557 g/mol
Monoisotopic Mass 242.08037557 g/mol
Topological Polar Surface Area 84 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 386
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

Lumichrome is a compound showing blue fluorescence, formed by a photolysis of riboflavin in acid or neutral solution. It has a role as a plant metabolite. It is functionally related to an alloxazine. It is a tautomer of a 7,8-dimethylisoalloxazine.