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68002-88-0

68002-88-0 structural image
Product Name: Fatty acids, C16-22
Formula: C19H38O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White flakes; [Sigma-Aldrich MSDS]
Boiling Point 300.00 °C. @ 760.00 mm Hg
Melting Point 69.4 °C
Collision Cross Section 181.46 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Sample Type: Fruit fly; Dataset: Unambiguous Lipids]
Kovats Retention Index 2236
Chemical Classes Lipids -> Unambiguous Lipids

COMPUTED DESCRIPTORS

Molecular Weight 298.5 g/mol
XLogP3 8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 17
Exact Mass 298.287180451 g/mol
Monoisotopic Mass 298.287180451 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 214
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

Nonadecanoic acid is a C19 straight-chain fatty acid of plant or bacterial origin. An intermediate in the biodegradation of n-icosane, it has been shown to inhibit cancer growth. It has a role as a fungal metabolite. It is a straight-chain saturated fatty acid and a long-chain fatty acid. It is a conjugate acid of a nonadecanoate.