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200501-98-0 | Butane, 1,1,1,2-tetrafluoro-2-(trifluoromethoxy)-
CAS No: 200501-98-0 Catalog No: AG002CT8 MDL No:
Product Description
Catalog Number:
AG002CT8
Chemical Name:
Butane, 1,1,1,2-tetrafluoro-2-(trifluoromethoxy)-
CAS Number:
200501-98-0
Molecular Formula:
C5H5F7O
Molecular Weight:
214.0814
IUPAC Name:
1,1,1,2-tetrafluoro-2-(trifluoromethoxy)butane
InChI:
InChI=1S/C5H5F7O/c1-2-3(6,4(7,8)9)13-5(10,11)12/h2H2,1H3
InChI Key:
CVIXMBCGUZGAQK-UHFFFAOYSA-N
SMILES:
CCC(C(F)(F)F)(OC(F)(F)F)F
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.023g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.083g/mol
Monoisotopic Mass:
214.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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