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85541-42-0

85541-42-0 structural image
Product Name: OCTADECANOIC ACID-1-13C
Formula: C18H36O2
Synonyms: 13C Labeled stearic acid;1-Heptadecanecarboxylic acid-1-13C;Cetylacetic acid-1-13C;Octadecanoic acid-1-13C;Stearophanic acid-1-13C
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation

COMPUTED DESCRIPTORS

Molecular Weight 285.5 g/mol
XLogP3 7.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 16
Exact Mass 285.274885222 g/mol
Monoisotopic Mass 285.274885222 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 202
Isotope Atom Count 1
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