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155142-69-1 | Propanoic acid, 3,3-difluoro-
CAS No: 155142-69-1 Catalog No: AG001NNO MDL No:MFCD12024562
Product Description
Catalog Number:
AG001NNO
Chemical Name:
Propanoic acid, 3,3-difluoro-
CAS Number:
155142-69-1
Molecular Formula:
C3H4F2O2
Molecular Weight:
110.0595
MDL Number:
MFCD12024562
IUPAC Name:
3,3-difluoropropanoic acid
InChI:
InChI=1S/C3H4F2O2/c4-2(5)1-3(6)7/h2H,1H2,(H,6,7)
InChI Key:
SHJWFIDAWODQSR-UHFFFAOYSA-N
SMILES:
FC(CC(=O)O)F
Properties
Complexity:
71.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.018g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
110.06g/mol
Monoisotopic Mass:
110.018g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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