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114645-34-0 | Propanamide, 3,3,3-trifluoro-2-hydroxy-2-methyl-
CAS No: 114645-34-0 Catalog No: AG000EXJ MDL No:MFCD20691347
Product Description
Catalog Number:
AG000EXJ
Chemical Name:
Propanamide, 3,3,3-trifluoro-2-hydroxy-2-methyl-
CAS Number:
114645-34-0
Molecular Formula:
C4H6F3NO2
Molecular Weight:
157.0911
MDL Number:
MFCD20691347
IUPAC Name:
3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
InChI:
InChI=1S/C4H6F3NO2/c1-3(10,2(8)9)4(5,6)7/h10H,1H3,(H2,8,9)
InChI Key:
IVCQKNKGXMVJOZ-UHFFFAOYSA-N
SMILES:
NC(=O)C(C(F)(F)F)(O)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.035g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.092g/mol
Monoisotopic Mass:
157.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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