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506-38-7

506-38-7 structural image
Product Name: PENTACOSANOIC ACID
Formula: C25H50O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Collision Cross Section 202.36 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Sample Type: Human bronchoalveolar lavage fluid (BALF); Dataset: Unambiguous Lipids]
Chemical Classes Lipids -> Unambiguous Lipids

COMPUTED DESCRIPTORS

Molecular Weight 382.7 g/mol
XLogP3 11.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 23
Exact Mass 382.381080833 g/mol
Monoisotopic Mass 382.381080833 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 288
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

Pentacosanoic acid is a straight-chain saturated fatty acid and a very long-chain fatty acid. It is a conjugate acid of a pentacosanoate.