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20926-66-3

20926-66-3 | 1H-Azonine, octahydro-1-(5-methyl-5-nitro-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-

CAS No: 20926-66-3 Catalog No: AG002K5R MDL No:

Product Description

Catalog Number:
AG002K5R
Chemical Name:
1H-Azonine, octahydro-1-(5-methyl-5-nitro-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-
CAS Number:
20926-66-3
Molecular Formula:
C12H23N2O5P
Molecular Weight:
306.2952
IUPAC Name:
2-(azonan-1-yl)-5-methyl-5-nitro-1,3,2λ5-dioxaphosphinane 2-oxide
InChI:
InChI=1S/C12H23N2O5P/c1-12(14(15)16)10-18-20(17,19-11-12)13-8-6-4-2-3-5-7-9-13/h2-11H2,1H3
InChI Key:
HVHLKWUQCPYXPK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C1(C)COP(=O)(OC1)N1CCCCCCCC1
NSC Number:
110684

Properties

Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.134g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.299g/mol
Monoisotopic Mass:
306.134g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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