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Home > Other Heterocycles > 85118-69-0
85118-69-0 | 2,6,7-Trioxa-4-aza-1-phosphabicyclo[2.2.2]octane
CAS No: 85118-69-0 Catalog No: AG004R9J MDL No:
Product Description
Catalog Number:
AG004R9J
Chemical Name:
2,6,7-Trioxa-4-aza-1-phosphabicyclo[2.2.2]octane
CAS Number:
85118-69-0
Molecular Formula:
C3H6NO3P
Molecular Weight:
135.0584
IUPAC Name:
2,6,7-trioxa-4-aza-1-phosphabicyclo[2.2.2]octane
InChI:
InChI=1S/C3H6NO3P/c1-4-2-6-8(5-1)7-3-4/h1-3H2
InChI Key:
IFXIRXLFKLHQQU-UHFFFAOYSA-N
SMILES:
C1OP2OCN1CO2
Properties
Complexity:
81.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.009g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.059g/mol
Monoisotopic Mass:
135.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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