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186028-79-5

186028-79-5 structural image
Product Name: 2-Methylamino-1-(3,4-methylenedioxyphenyl)propan-1-one
Formula: C11H13NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 147.3 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Kovats Retention Index 1738.2

COMPUTED DESCRIPTORS

Molecular Weight 207.23 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 207.08954328 g/mol
Monoisotopic Mass 207.08954328 g/mol
Topological Polar Surface Area 47.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 244
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methylone is a member of benzodioxoles.