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Home > Fluorides > 132037-90-2
132037-90-2 | 2-Pyrrolidinone, 4-ethyl-3-phenyl-1-[3-(trifluoromethyl)phenyl]-
CAS No: 132037-90-2 Catalog No: AG001036 MDL No:
Product Description
Catalog Number:
AG001036
Chemical Name:
2-Pyrrolidinone, 4-ethyl-3-phenyl-1-[3-(trifluoromethyl)phenyl]-
CAS Number:
132037-90-2
Molecular Formula:
C19H18F3NO
Molecular Weight:
333.3475
IUPAC Name:
4-ethyl-3-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one
InChI:
InChI=1S/C19H18F3NO/c1-2-13-12-23(16-10-6-9-15(11-16)19(20,21)22)18(24)17(13)14-7-4-3-5-8-14/h3-11,13,17H,2,12H2,1H3
InChI Key:
DVMFCYVXYFMZLB-UHFFFAOYSA-N
SMILES:
CCC1CN(C(=O)C1c1ccccc1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.134g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.354g/mol
Monoisotopic Mass:
333.134g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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