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Tripentacontane

HCID 15043576
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Basic information

CAS
7719-80-4
Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
InChIKey
QRDHNELNZUIDDZ-UHFFFAOYSA-N
Molecular formula
C53H108
Average molar mass
745.4 g/mol
Monoisotopic mass
744.84510344

Names & identifiers

Preferred name
Tripentacontane
IUPAC
tripentacontane

Names & synonyms

TripentacontaneDTXSID205674237719-80-4RefChem:386500DTXCID20518197SCHEMBL199440SCHEMBL199441Q18456298

Database identifiers

CAS
7719-80-4
PubChem CID
15043576
DTXSID
DTXSID20567423
Nikkaji
J1.723.880I

Properties

Computed structural properties

XLogP
28.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
50
Heavy atoms
53
Formal charge
0
Complexity
529

Related reactions

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Compound notes

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