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Home > Fluorides > 1017294-08-4
1017294-08-4 | 5(4H)-Oxazolone, 4-[(2,5-difluorophenyl)methylene]-2-methyl-
CAS No: 1017294-08-4 Catalog No: AG0005BG MDL No:
Product Description
Catalog Number:
AG0005BG
Chemical Name:
5(4H)-Oxazolone, 4-[(2,5-difluorophenyl)methylene]-2-methyl-
CAS Number:
1017294-08-4
Molecular Formula:
C11H7F2NO2
Molecular Weight:
223.1756
IUPAC Name:
(4Z)-4-[(2,5-difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5-one
InChI:
InChI=1S/C11H7F2NO2/c1-6-14-10(11(15)16-6)5-7-4-8(12)2-3-9(7)13/h2-5H,1H3/b10-5-
InChI Key:
WXPBRLXDFVOOBC-YHYXMXQVSA-N
SMILES:
CC1=NC(=Cc2cc(F)ccc2F)C(=O)O1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
223.044g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.179g/mol
Monoisotopic Mass:
223.044g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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