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76535-37-0 | Pentatriacontane, 9,13-dimethyl-
CAS No: 76535-37-0 Catalog No: AG005KHF MDL No:
Product Description
Catalog Number:
AG005KHF
Chemical Name:
Pentatriacontane, 9,13-dimethyl-
CAS Number:
76535-37-0
Molecular Formula:
C37H76
Molecular Weight:
520.9993
IUPAC Name:
9,13-dimethylpentatriacontane
InChI:
InChI=1S/C37H76/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28-30-33-37(4)35-31-34-36(3)32-29-27-12-10-8-6-2/h36-37H,5-35H2,1-4H3
InChI Key:
MCKWDTXLZQPZFA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCCCC(CCCC(CCCCCCCC)C)C
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
520.595g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
521.015g/mol
Monoisotopic Mass:
520.595g/mol
Rotatable Bond Count:
32
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
19.7
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