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93913-28-1

93913-28-1 structural image
Product Name: Benzene, (1-ethynyl-1-methyl-2-propyn-1-yl)-
Formula: C12H10
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COMPUTED DESCRIPTORS

Molecular Weight 154.21 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 3
Exact Mass 154.078250319 g/mol
Monoisotopic Mass 154.078250319 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 220
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

(3-Methylpenta-1,4-diyn-3-yl)benzene is a natural product found in Artemisia monosperma with data available.