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131118-28-0 | Butanal, 4-chloro-3,3,4,4-tetrafluoro-
CAS No: 131118-28-0 Catalog No: AG000VJF MDL No:
Product Description
Catalog Number:
AG000VJF
Chemical Name:
Butanal, 4-chloro-3,3,4,4-tetrafluoro-
CAS Number:
131118-28-0
Molecular Formula:
C4H3ClF4O
Molecular Weight:
178.5126
IUPAC Name:
4-chloro-3,3,4,4-tetrafluorobutanal
InChI:
InChI=1S/C4H3ClF4O/c5-4(8,9)3(6,7)1-2-10/h2H,1H2
InChI Key:
WXCUSEKTKJXMRQ-UHFFFAOYSA-N
SMILES:
O=CCC(C(Cl)(F)F)(F)F
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.981g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.511g/mol
Monoisotopic Mass:
177.981g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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