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116963-80-5 | Benzene, 1-iodo-4-(trans-4-pentylcyclohexyl)-
CAS No: 116963-80-5 Catalog No: AG000DEX MDL No:
Product Description
Catalog Number:
AG000DEX
Chemical Name:
Benzene, 1-iodo-4-(trans-4-pentylcyclohexyl)-
CAS Number:
116963-80-5
Molecular Formula:
C17H25I
Molecular Weight:
356.2849
IUPAC Name:
1-iodo-4-(4-pentylcyclohexyl)benzene
InChI:
InChI=1S/C17H25I/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(18)13-11-16/h10-15H,2-9H2,1H3
InChI Key:
ZVJXAYCOQJDVMP-UHFFFAOYSA-N
SMILES:
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)I
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.291g/mol
Monoisotopic Mass:
356.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
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