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168851-08-9 | Pentatriacontane, trimethyl-
CAS No: 168851-08-9 Catalog No: AG001YC4 MDL No:
Product Description
Catalog Number:
AG001YC4
Chemical Name:
Pentatriacontane, trimethyl-
CAS Number:
168851-08-9
Molecular Formula:
C38H78
Molecular Weight:
535.0259
IUPAC Name:
2,2-dimethylhexatriacontane
InChI:
InChI=1S/C38H78/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38(2,3)4/h5-37H2,1-4H3
InChI Key:
NGRVIUVJCZOWGE-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)(C)C
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
534.61g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
535.042g/mol
Monoisotopic Mass:
534.61g/mol
Rotatable Bond Count:
33
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
20.4
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