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Home > Pyridines > 101126-68-5
101126-68-5 | Pyrido[1,2-b][1,5,2]dioxazine-2,4,8-trione
CAS No: 101126-68-5 Catalog No: AG0003SW MDL No:
Product Description
Catalog Number:
AG0003SW
Chemical Name:
Pyrido[1,2-b][1,5,2]dioxazine-2,4,8-trione
CAS Number:
101126-68-5
Molecular Formula:
C7H3NO5
Molecular Weight:
181.1024
IUPAC Name:
pyrido[1,2-b][1,5,2]dioxazine-2,4,8-trione
InChI:
InChI=1S/C7H3NO5/c9-5-3-1-2-4-6(10)12-7(11)13-8(4)5/h1-3H
InChI Key:
OFKGPEBMAMSWHP-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)c2n(o1)c(=O)ccc2
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.001g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.103g/mol
Monoisotopic Mass:
181.001g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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