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120047-79-2 | 1,3,2-Dioxazolium, 4,5-dihydro-
CAS No: 120047-79-2 Catalog No: AG000Q6V MDL No:
Product Description
Catalog Number:
AG000Q6V
Chemical Name:
1,3,2-Dioxazolium, 4,5-dihydro-
CAS Number:
120047-79-2
Molecular Formula:
C2H6NO2+
Molecular Weight:
76.0745
IUPAC Name:
4,5-dihydro-1,3,2-dioxazol-1-ium
InChI:
InChI=1S/C2H4NO2/c1-2-5-3-4-1/h1-2H2/q+1
InChI Key:
XQHQMCZXNJFFHD-UHFFFAOYSA-N
SMILES:
C1CO[NH2+]O1
Properties
Complexity:
44.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
74.024g/mol
Formal Charge:
1
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
74.059g/mol
Monoisotopic Mass:
74.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
22.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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