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Home > Other Heterocycles > 10022-55-6
10022-55-6 | 2,8,9-Trioxa-5-aza-1-phosphabicyclo[3.3.3]undecane, 1-oxide
CAS No: 10022-55-6 Catalog No: AG0001AE MDL No:
Product Description
Catalog Number:
AG0001AE
Chemical Name:
2,8,9-Trioxa-5-aza-1-phosphabicyclo[3.3.3]undecane, 1-oxide
CAS Number:
10022-55-6
Molecular Formula:
C6H12NO4P
Molecular Weight:
193.1375
IUPAC Name:
2,8,9-trioxa-5-aza-1λ5-phosphabicyclo[3.3.3]undecane 1-oxide
InChI:
InChI=1S/C6H12NO4P/c8-12-9-4-1-7(2-5-10-12)3-6-11-12/h1-6H2
InChI Key:
QNJNEYSOGIMLRI-UHFFFAOYSA-N
SMILES:
O=P12OCCN(CCO1)CCO2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.139g/mol
Monoisotopic Mass:
193.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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