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Home > Nitro Compounds > 69706-57-6
69706-57-6 | 4H-Cyclopenta[def]phenanthren-4-one, 8-nitro-
CAS No: 69706-57-6 Catalog No: AG00FONH MDL No:
Product Description
Catalog Number:
AG00FONH
Chemical Name:
4H-Cyclopenta[def]phenanthren-4-one, 8-nitro-
CAS Number:
69706-57-6
IUPAC Name:
4-ethyl-4-methyloxane-2,6-dione
InChI:
InChI=1S/C8H12O3/c1-3-8(2)4-6(9)11-7(10)5-8/h3-5H2,1-2H3
InChI Key:
VSVZSLYJGKSCBI-UHFFFAOYSA-N
EC Number:
230-194-4
NSC Number:
62024
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.181g/mol
Monoisotopic Mass:
156.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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