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Home > Nitro Compounds > 20934-09-2
20934-09-2 | Aziridine, 1-(5-ethyl-5-nitro-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-
CAS No: 20934-09-2 Catalog No: AG002K74 MDL No:
Product Description
Catalog Number:
AG002K74
Chemical Name:
Aziridine, 1-(5-ethyl-5-nitro-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-
CAS Number:
20934-09-2
Molecular Formula:
C7H13N2O5P
Molecular Weight:
236.1623
IUPAC Name:
2-(aziridin-1-yl)-5-ethyl-5-nitro-1,3,2λ5-dioxaphosphinane 2-oxide
InChI:
InChI=1S/C7H13N2O5P/c1-2-7(9(10)11)5-13-15(12,14-6-7)8-3-4-8/h2-6H2,1H3
InChI Key:
NYUKAUJMJZJATL-UHFFFAOYSA-N
SMILES:
CCC1(COP(=O)(OC1)N1CC1)[N+](=O)[O-]
NSC Number:
108614
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.164g/mol
Monoisotopic Mass:
236.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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