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Home > Nitro Compounds > 73811-07-1
73811-07-1 | 1H-Perimidine, 4,6,7,9-tetranitro-
CAS No: 73811-07-1 Catalog No: AG005KBX MDL No:
Product Description
Catalog Number:
AG005KBX
Chemical Name:
1H-Perimidine, 4,6,7,9-tetranitro-
CAS Number:
73811-07-1
Molecular Formula:
C11H4N6O8
Molecular Weight:
348.1849
IUPAC Name:
4,6,7,9-tetranitro-1H-perimidine
InChI:
InChI=1S/C11H4N6O8/c18-14(19)4-1-6(16(22)23)10-9-8(4)5(15(20)21)2-7(17(24)25)11(9)13-3-12-10/h1-3H,(H,12,13)
InChI Key:
GHNVCALBWYIMHG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc([N+](=O)[O-])c2c3c1nc[nH]c3c(cc2[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
647
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.009g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
348.187g/mol
Monoisotopic Mass:
348.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
208A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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