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Home > Nitro Compounds > 98556-67-3
98556-67-3 | 5,7-Dinitrobenzofuran-3(2h)-one
CAS No: 98556-67-3 Catalog No: AG00IK4S MDL No:MFCD22415701
Product Description
Catalog Number:
AG00IK4S
Chemical Name:
5,7-Dinitrobenzofuran-3(2h)-one
CAS Number:
98556-67-3
MDL Number:
MFCD22415701
IUPAC Name:
5,7-dinitro-1-benzofuran-3-one
InChI:
InChI=1S/C8H4N2O6/c11-7-3-16-8-5(7)1-4(9(12)13)2-6(8)10(14)15/h1-2H,3H2
InChI Key:
MPPJNPIHMKGRCX-UHFFFAOYSA-N
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.007g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.128g/mol
Monoisotopic Mass:
224.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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