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136585-40-5 | Cyclopentane, tris(2-octyldodecyl)-
CAS No: 136585-40-5 Catalog No: AG00123X MDL No:
Product Description
Catalog Number:
AG00123X
Chemical Name:
Cyclopentane, tris(2-octyldodecyl)-
CAS Number:
136585-40-5
Molecular Formula:
C65H130
Molecular Weight:
911.7277
IUPAC Name:
1,1,2-tris(2-octyldodecyl)cyclopentane
InChI:
InChI=1S/C65H130/c1-7-13-19-25-31-34-40-44-51-61(50-43-37-28-22-16-10-4)58-64-56-49-57-65(64,59-62(52-45-38-29-23-17-11-5)54-47-41-35-32-26-20-14-8-2)60-63(53-46-39-30-24-18-12-6)55-48-42-36-33-27-21-15-9-3/h61-64H,7-60H2,1-6H3
InChI Key:
OENUPTUJRRJBRI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC(CC1CCCC1(CC(CCCCCCCCCC)CCCCCCCC)CC(CCCCCCCCCC)CCCCCCCC)CCCCCCCC
Properties
Complexity:
845
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
911.017g/mol
Formal Charge:
0
Heavy Atom Count:
65
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
911.755g/mol
Monoisotopic Mass:
911.017g/mol
Rotatable Bond Count:
54
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
33.6
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