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885044-47-3 | N-(3-HYDROXY-5-TRIFLUOROMETHYLPHENYL)ACRYLAMIDE
CAS No: 885044-47-3 Catalog No: AG00489X MDL No:
Product Description
Catalog Number:
AG00489X
Chemical Name:
N-(3-HYDROXY-5-TRIFLUOROMETHYLPHENYL)ACRYLAMIDE
CAS Number:
885044-47-3
Molecular Formula:
C10H8F3NO2
Molecular Weight:
231.1712
IUPAC Name:
N-[3-hydroxy-5-(trifluoromethyl)phenyl]prop-2-enamide
InChI:
InChI=1S/C10H8F3NO2/c1-2-9(16)14-7-3-6(10(11,12)13)4-8(15)5-7/h2-5,15H,1H2,(H,14,16)
InChI Key:
OVHVMSFNKNDOPO-UHFFFAOYSA-N
SMILES:
C=CC(=O)Nc1cc(O)cc(c1)C(F)(F)F
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.174g/mol
Monoisotopic Mass:
231.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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