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Structure

N-Pentatriacontane

CAS
630-07-9
Catalog Number
ACM630079
Category
Other Products
Molecular Weight
492.9
Molecular Formula
C35H72

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Specification

Synonyms
Pentatriacontane, N-PENTATRIACONTANE, Pentatriacontane (8CI)(9CI), 76968_FLUKA, MolPort-003-939-002, CID12413, NSC125400, NSC 125400, TL8004361, P0062, 25E3ABFD-53A7-41A8-9766-C537F92EC7FF, 630-07-9
IUPAC Name
pentatriacontane
Canonical SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
InChI Key
VHQQPFLOGSTQPC-UHFFFAOYSA-N
Boiling Point
331ºC / 15mmHg
Melting Point
73-75ºC
Flash Point
355.9ºC
Density
0.813g/cm³
Complexity
301
Defined Atom Stereocenter Count
0
Exact Mass
492.5634
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
35
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
492.5634
Rotatable Bond Count
32
Safety Description
24/25
Topological Polar Surface Area
0 Ų
XLogP3-AA
18.6
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