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145547-89-3 | Propane, 1-[dichloro(2,2-dinitropropoxy)methoxy]-2,2-dinitro-
CAS No: 145547-89-3 Catalog No: AG001D65 MDL No:
Product Description
Catalog Number:
AG001D65
Chemical Name:
Propane, 1-[dichloro(2,2-dinitropropoxy)methoxy]-2,2-dinitro-
CAS Number:
145547-89-3
Molecular Formula:
C7H10Cl2N4O10
Molecular Weight:
381.0811
IUPAC Name:
1-[dichloro(2,2-dinitropropoxy)methoxy]-2,2-dinitropropane
InChI:
InChI=1S/C7H10Cl2N4O10/c1-5(10(14)15,11(16)17)3-22-7(8,9)23-4-6(2,12(18)19)13(20)21/h3-4H2,1-2H3
InChI Key:
SWCFSWCYANTYMN-UHFFFAOYSA-N
SMILES:
ClC(OCC([N+](=O)[O-])([N+](=O)[O-])C)(OCC([N+](=O)[O-])([N+](=O)[O-])C)Cl
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.977g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.075g/mol
Monoisotopic Mass:
379.977g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
202A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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