200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 88538-42-5
88538-42-5 | 1,5-Diazocine, octahydro-1-(1-methylethyl)-3,3,7,7-tetranitro-5-nitroso-
CAS No: 88538-42-5 Catalog No: AG0045P2 MDL No:
Product Description
Catalog Number:
AG0045P2
Chemical Name:
1,5-Diazocine, octahydro-1-(1-methylethyl)-3,3,7,7-tetranitro-5-nitroso-
CAS Number:
88538-42-5
Molecular Formula:
C9H15N7O9
Molecular Weight:
365.2569
IUPAC Name:
3,3,7,7-tetranitro-1-nitroso-5-propan-2-yl-1,5-diazocane
InChI:
InChI=1S/C9H15N7O9/c1-7(2)11-3-8(13(18)19,14(20)21)5-12(10-17)6-9(4-11,15(22)23)16(24)25/h7H,3-6H2,1-2H3
InChI Key:
MLLSCYPOIKHTPH-UHFFFAOYSA-N
SMILES:
O=NN1CC(CN(CC(C1)([N+](=O)[O-])[N+](=O)[O-])C(C)C)([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.093g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
365.259g/mol
Monoisotopic Mass:
365.093g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
219A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.