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79864-51-0 | Heptacosane, 7,11-dimethyl-
CAS No: 79864-51-0 Catalog No: AG004ZEV MDL No:
Product Description
Catalog Number:
AG004ZEV
Chemical Name:
Heptacosane, 7,11-dimethyl-
CAS Number:
79864-51-0
Molecular Formula:
C29H60
Molecular Weight:
408.7867
IUPAC Name:
7,11-dimethylheptacosane
InChI:
InChI=1S/C29H60/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-22-25-29(4)27-23-26-28(3)24-21-10-8-6-2/h28-29H,5-27H2,1-4H3
InChI Key:
GKFDFPQEEBHPAD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCC(CCCC(CCCCCC)C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.47g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
408.799g/mol
Monoisotopic Mass:
408.47g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
15.3
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