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Home > Nitro Compounds > 7692-92-4
7692-92-4 | 4-methyl-3-(4-nitrophenyl)-2,5-dihydrofuran-2-one
CAS No: 7692-92-4 Catalog No: AG00IZ2A MDL No:MFCD00139240
Product Description
Catalog Number:
AG00IZ2A
Chemical Name:
4-methyl-3-(4-nitrophenyl)-2,5-dihydrofuran-2-one
CAS Number:
7692-92-4
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
MDL Number:
MFCD00139240
IUPAC Name:
3-methyl-4-(4-nitrophenyl)-2H-furan-5-one
InChI:
InChI=1S/C11H9NO4/c1-7-6-16-11(13)10(7)8-2-4-9(5-3-8)12(14)15/h2-5H,6H2,1H3
InChI Key:
GEXNQAMOJXONNA-UHFFFAOYSA-N
SMILES:
CC1=C(C(=O)OC1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.196g/mol
Monoisotopic Mass:
219.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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