Home Nitros 1-(2,4-dimethyl-3,5-dinitrophenyl)ethan-1-one

1-(2,4-dimethyl-3,5-dinitrophenyl)ethan-1-one

CAS No.:
1251924-56-7
Catalog Number:
AG01A9Z3
Molecular Formula:
C10H10N2O5
Molecular Weight:
238.1968
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Product Description
Catalog Number:
AG01A9Z3
Chemical Name:
1-(2,4-dimethyl-3,5-dinitrophenyl)ethan-1-one
CAS Number:
1251924-56-7
Molecular Formula:
C10H10N2O5
Molecular Weight:
238.1968
MDL Number:
MFCD16817503
IUPAC Name:
1-(2,4-dimethyl-3,5-dinitrophenyl)ethanone
InChI:
InChI=1S/C10H10N2O5/c1-5-8(7(3)13)4-9(11(14)15)6(2)10(5)12(16)17/h4H,1-3H3
InChI Key:
QBSQTWSZUGJUBI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)C)c(c(c1C)[N+](=O)[O-])C
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.059g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.199g/mol
Monoisotopic Mass:
238.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties