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7226-98-4 | 1-methoxyaziridine-2,2-dicarboxamide
CAS No: 7226-98-4 Catalog No: AG005IG6 MDL No:
Product Description
Catalog Number:
AG005IG6
Chemical Name:
1-methoxyaziridine-2,2-dicarboxamide
CAS Number:
7226-98-4
Molecular Formula:
C5H9N3O3
Molecular Weight:
159.1433
IUPAC Name:
1-methoxyaziridine-2,2-dicarboxamide
InChI:
InChI=1S/C5H9N3O3/c1-11-8-2-5(8,3(6)9)4(7)10/h2H2,1H3,(H2,6,9)(H2,7,10)
InChI Key:
XEHLHVSHUHMYMO-UHFFFAOYSA-N
SMILES:
CON1CC1(C(=O)N)C(=O)N
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
159.145g/mol
Monoisotopic Mass:
159.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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