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77517-69-2 | Cycloheptane, 1-fluoro-2-iodo-
CAS No: 77517-69-2 Catalog No: AG005H3M MDL No:
Product Description
Catalog Number:
AG005H3M
Chemical Name:
Cycloheptane, 1-fluoro-2-iodo-
CAS Number:
77517-69-2
Molecular Formula:
C7H12FI
Molecular Weight:
242.0731
IUPAC Name:
1-fluoro-2-iodocycloheptane
InChI:
InChI=1S/C7H12FI/c8-6-4-2-1-3-5-7(6)9/h6-7H,1-5H2
InChI Key:
ZNDHKPMMDGOYND-UHFFFAOYSA-N
SMILES:
FC1CCCCCC1I
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.997g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.076g/mol
Monoisotopic Mass:
241.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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