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Home > Nitro Compounds > 2363-39-5
2363-39-5 | Benzene, 2,4-dinitro-1-(2-nitrophenoxy)-
CAS No: 2363-39-5 Catalog No: AG002NYM MDL No:
Product Description
Catalog Number:
AG002NYM
Chemical Name:
Benzene, 2,4-dinitro-1-(2-nitrophenoxy)-
CAS Number:
2363-39-5
Molecular Formula:
C12H7N3O7
Molecular Weight:
305.1999
IUPAC Name:
2,4-dinitro-1-(2-nitrophenoxy)benzene
InChI:
InChI=1S/C12H7N3O7/c16-13(17)8-5-6-12(10(7-8)15(20)21)22-11-4-2-1-3-9(11)14(18)19/h1-7H
InChI Key:
ZFPQCDUWZQROIK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Oc1ccccc1[N+](=O)[O-])[N+](=O)[O-]
NSC Number:
19872
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.028g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.202g/mol
Monoisotopic Mass:
305.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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