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125290-76-8 | Oxazole, 2-(3-chloro-2,4,5-trifluorophenyl)-4,5-dihydro-4,4-dimethyl-
CAS No: 125290-76-8 Catalog No: AG000NGD MDL No:
Product Description
Catalog Number:
AG000NGD
Chemical Name:
Oxazole, 2-(3-chloro-2,4,5-trifluorophenyl)-4,5-dihydro-4,4-dimethyl-
CAS Number:
125290-76-8
Molecular Formula:
C11H9ClF3NO
Molecular Weight:
263.6435
IUPAC Name:
2-(3-chloro-2,4,5-trifluorophenyl)-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C11H9ClF3NO/c1-11(2)4-17-10(16-11)5-3-6(13)9(15)7(12)8(5)14/h3H,4H2,1-2H3
InChI Key:
IUMQZQZGWNIUDS-UHFFFAOYSA-N
SMILES:
Fc1c(cc(c(c1Cl)F)F)C1=NC(CO1)(C)C
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.032g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.644g/mol
Monoisotopic Mass:
263.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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