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Home > Fluorides > 289722-47-0
289722-47-0 | Bicyclo[2.2.1]heptane-7-carbonyl fluoride, 2,2-difluoro-1,7-dimethyl-, (1R,4R,7R)-
CAS No: 289722-47-0 Catalog No: AG002V1U MDL No:
Product Description
Catalog Number:
AG002V1U
Chemical Name:
Bicyclo[2.2.1]heptane-7-carbonyl fluoride, 2,2-difluoro-1,7-dimethyl-, (1R,4R,7R)-
CAS Number:
289722-47-0
Molecular Formula:
C10H13F3O
Molecular Weight:
206.2048
IUPAC Name:
(1R,4R,7R)-2,2-difluoro-1,7-dimethylbicyclo[2.2.1]heptane-7-carbonyl fluoride
InChI:
InChI=1S/C10H13F3O/c1-8-4-3-6(5-10(8,12)13)9(8,2)7(11)14/h6H,3-5H2,1-2H3/t6-,8-,9+/m1/s1
InChI Key:
AVUXUIGGFQQKSN-VDAHYXPESA-N
SMILES:
FC(=O)[C@]1(C)[C@@H]2CC[C@@]1(C)C(C2)(F)F
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
206.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.208g/mol
Monoisotopic Mass:
206.092g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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