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3048-73-5

3048-73-5 | 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-nitro-

CAS No: 3048-73-5 Catalog No: AG00309J MDL No:

Product Description

Catalog Number:
AG00309J
Chemical Name:
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-nitro-
CAS Number:
3048-73-5
Molecular Formula:
C4H6NO5P
Molecular Weight:
179.0679
IUPAC Name:
4-nitro-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane
InChI:
InChI=1S/C4H6NO5P/c6-5(7)4-1-8-11(9-2-4)10-3-4/h1-3H2
InChI Key:
UTQLCFUCRQSESN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C12COP(OC1)OC2

Properties

Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.998g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.068g/mol
Monoisotopic Mass:
178.998g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

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