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820233-09-8 | Cyclohexane, 1,4-dihexyl-, trans-
CAS No: 820233-09-8 Catalog No: AG004YFB MDL No:
Product Description
Catalog Number:
AG004YFB
Chemical Name:
Cyclohexane, 1,4-dihexyl-, trans-
CAS Number:
820233-09-8
Molecular Formula:
C18H36
Molecular Weight:
252.4784
IUPAC Name:
1,4-dihexylcyclohexane
InChI:
InChI=1S/C18H36/c1-3-5-7-9-11-17-13-15-18(16-14-17)12-10-8-6-4-2/h17-18H,3-16H2,1-2H3
InChI Key:
NISYXSGVXWMZQC-UHFFFAOYSA-N
SMILES:
CCCCCC[C@@H]1CC[C@H](CC1)CCCCCC
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.282g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.486g/mol
Monoisotopic Mass:
252.282g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.2
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