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40411-22-1 | 1-(2-METHOXYETHYL)IMIDAZOLIDINE-2,4,5-TRIONE
CAS No: 40411-22-1 Catalog No: AG00D6C4 MDL No:MFCD08729254
Product Description
Catalog Number:
AG00D6C4
Chemical Name:
1-(2-METHOXYETHYL)IMIDAZOLIDINE-2,4,5-TRIONE
CAS Number:
40411-22-1
Molecular Formula:
C6H8N2O4
Molecular Weight:
172.1387
MDL Number:
MFCD08729254
IUPAC Name:
1-(2-methoxyethyl)imidazolidine-2,4,5-trione
InChI:
InChI=1S/C6H8N2O4/c1-12-3-2-8-5(10)4(9)7-6(8)11/h2-3H2,1H3,(H,7,9,11)
InChI Key:
ZNIGPCKVZUTFFS-UHFFFAOYSA-N
SMILES:
COCCN1C(=O)NC(=O)C1=O
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.14g/mol
Monoisotopic Mass:
172.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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