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2366-62-3 | Butanoic acid, 2,2-difluoro-
CAS No: 2366-62-3 Catalog No: AG002O2R MDL No:MFCD03093765
Product Description
Catalog Number:
AG002O2R
Chemical Name:
Butanoic acid, 2,2-difluoro-
CAS Number:
2366-62-3
Molecular Formula:
C4H6F2O2
Molecular Weight:
124.0860
MDL Number:
MFCD03093765
IUPAC Name:
2,2-difluorobutanoic acid
InChI:
InChI=1S/C4H6F2O2/c1-2-4(5,6)3(7)8/h2H2,1H3,(H,7,8)
InChI Key:
SBSKRVZFWQPJID-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)(F)F
Properties
Complexity:
100
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.034g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.087g/mol
Monoisotopic Mass:
124.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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