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37428-73-2 | 1-(1-ADAMANTYL)IMIDAZOLIDINE-2,4,5-TRIONE
CAS No: 37428-73-2 Catalog No: AG0079RF MDL No:MFCD06380324
Product Description
Catalog Number:
AG0079RF
Chemical Name:
1-(1-ADAMANTYL)IMIDAZOLIDINE-2,4,5-TRIONE
CAS Number:
37428-73-2
Molecular Formula:
C13H16N2O3
Molecular Weight:
248.2777
MDL Number:
MFCD06380324
IUPAC Name:
1-(1-adamantyl)imidazolidine-2,4,5-trione
InChI:
InChI=1S/C13H16N2O3/c16-10-11(17)15(12(18)14-10)13-4-7-1-8(5-13)3-9(2-7)6-13/h7-9H,1-6H2,(H,14,16,18)
InChI Key:
HSAMZIXLIWFURG-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)N(C1=O)C12CC3CC(C2)CC(C1)C3
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.282g/mol
Monoisotopic Mass:
248.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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