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141-10-6

141-10-6 structural image
Product Name: PSEUDOIONONE
Formula: C13H20O
Synonyms: ψ-Ionone;6,10-Dimethyl-3,5,9-undecatrien-2-one
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point < 25 °C
Solubility Practically insoluble to insoluble
Density 0.894-0.903
Refractive Index 1.529-1.535
Kovats Retention Index 1562 1563 1519 1563

COMPUTED DESCRIPTORS

Molecular Weight 192.30 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 5
Exact Mass 192.151415257 g/mol
Monoisotopic Mass 192.151415257 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 263
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Pseudoionone is a terpene ketone derived from ring cleavage of the apo carotenoid beta-ionone. It has a role as a fragrance. It is functionally related to a beta-ionone.