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Home > Nitro Compounds > 77508-73-7
77508-73-7 | 1-[4,5-Dihydro-3-(4-nitrophenyl)-5-phenylisoxazol-4-yl]ethanone
CAS No: 77508-73-7 Catalog No: AG00GPMW MDL No:
Product Description
Catalog Number:
AG00GPMW
Chemical Name:
1-[4,5-Dihydro-3-(4-nitrophenyl)-5-phenylisoxazol-4-yl]ethanone
CAS Number:
77508-73-7
IUPAC Name:
1-[3-(4-nitrophenyl)-5-phenyl-4,5-dihydro-1,2-oxazol-4-yl]ethanone
InChI:
InChI=1S/C17H14N2O4/c1-11(20)15-16(12-7-9-14(10-8-12)19(21)22)18-23-17(15)13-5-3-2-4-6-13/h2-10,15,17H,1H3
InChI Key:
HYCJPHWQBZGJKK-UHFFFAOYSA-N
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.095g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.309g/mol
Monoisotopic Mass:
310.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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