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297-58-5

297-58-5 | Cyclodotetracontane (6CI,7CI,8CI,9CI)

CAS No: 297-58-5 Catalog No: AG002Z5T MDL No:

Product Description

Catalog Number:
AG002Z5T
Chemical Name:
Cyclodotetracontane (6CI,7CI,8CI,9CI)
CAS Number:
297-58-5
Molecular Formula:
C42H84
Molecular Weight:
589.1164
IUPAC Name:
cyclodotetracontane
InChI:
InChI=1S/C42H84/c1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1/h1-42H2
InChI Key:
HGYWDMKVEUIDAK-UHFFFAOYSA-N
SMILES:
C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
588.657g/mol
Formal Charge:
0
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
589.134g/mol
Monoisotopic Mass:
588.657g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
22.7  

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