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2404-36-6 | Cycloheptane, iodo-
CAS No: 2404-36-6 Catalog No: AG007O9Q MDL No:
Product Description
Catalog Number:
AG007O9Q
Chemical Name:
Cycloheptane, iodo-
CAS Number:
2404-36-6
Molecular Formula:
C7H13I
Molecular Weight:
224.0826
IUPAC Name:
iodocycloheptane
InChI:
InChI=1S/C7H13I/c8-7-5-3-1-2-4-6-7/h7H,1-6H2
InChI Key:
ZQCXCNPOYCQOEW-UHFFFAOYSA-N
SMILES:
IC1CCCCCC1
Properties
Complexity:
53.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.006g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.085g/mol
Monoisotopic Mass:
224.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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