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116935-82-1 | Bicyclo[2.2.2]octane-1-carbonyl fluoride, 4-methyl-
CAS No: 116935-82-1 Catalog No: AG000DEE MDL No:
Product Description
Catalog Number:
AG000DEE
Chemical Name:
Bicyclo[2.2.2]octane-1-carbonyl fluoride, 4-methyl-
CAS Number:
116935-82-1
Molecular Formula:
C10H15FO
Molecular Weight:
170.2239
IUPAC Name:
4-methylbicyclo[2.2.2]octane-1-carbonyl fluoride
InChI:
InChI=1S/C10H15FO/c1-9-2-5-10(6-3-9,7-4-9)8(11)12/h2-7H2,1H3
InChI Key:
BIDAWIQERDFBDB-UHFFFAOYSA-N
SMILES:
FC(=O)C12CCC(CC1)(CC2)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.227g/mol
Monoisotopic Mass:
170.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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