Home Other Building Blocks 2,2-difluoro-3-iodocycloheptan-1-one

2,2-difluoro-3-iodocycloheptan-1-one

CAS No.:
1777805-09-0
Catalog Number:
AG01ELXK
Molecular Formula:
C7H9F2IO
Molecular Weight:
274.0470
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Product Description
Catalog Number:
AG01ELXK
Chemical Name:
2,2-difluoro-3-iodocycloheptan-1-one
CAS Number:
1777805-09-0
Molecular Formula:
C7H9F2IO
Molecular Weight:
274.0470
MDL Number:
MFCD31617323
IUPAC Name:
2,2-difluoro-3-iodocycloheptan-1-one
InChI:
InChI=1S/C7H9F2IO/c8-7(9)5(10)3-1-2-4-6(7)11/h5H,1-4H2
InChI Key:
KUFPFIRHCCPUQP-UHFFFAOYSA-N
SMILES:
IC1CCCCC(=O)C1(F)F
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.967g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.049g/mol
Monoisotopic Mass:
273.967g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties