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88673-04-5 | 3-Oxaziridinecarbonitrile
CAS No: 88673-04-5 Catalog No: AG0048D6 MDL No:
Product Description
Catalog Number:
AG0048D6
Chemical Name:
3-Oxaziridinecarbonitrile
CAS Number:
88673-04-5
Molecular Formula:
C2H2N2O
Molecular Weight:
70.0501
IUPAC Name:
oxaziridine-3-carbonitrile
InChI:
InChI=1S/C2H2N2O/c3-1-2-4-5-2/h2,4H
InChI Key:
SFAJKDVFBBEEFH-UHFFFAOYSA-N
SMILES:
N1OC1C#N
Properties
Complexity:
80.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
70.017g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
70.051g/mol
Monoisotopic Mass:
70.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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