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5-cyclopropyl-5-methyl-imidazolidine-2,4-dione 5470-46-2 98%
【Name】
5-cyclopropyl-5-methylimidazolidine-2,4-dione
【CAS Registry number】
5470-46-2
【Synonyms】
2,4-imidazolidinedione, 5-cyclopropyl-5-methyl-
5-Cyclopropyl-5-methylimidazolidine-2,4-dione
【Molecular Formula】
C7H10N2O2 (Products with the same molecular formula)
【Molecular Weight】
154.1665
【Inchi】
InChI=1/C7H10N2O2/c1-7(4-2-3-4)5(10)8-6(11)9-7/h4H,2-3H2,1H3,(H2,8,9,10,11)
【Canonical SMILES】
CC1(C(=O)NC(=O)N1)C2CC2
【MOL File】
5470-46-2.mol
Chemical and Physical Properties
【Density】
1.294g/cm3
【Boiling Point】
°Cat760mmHg
【Refractive Index】
1.538
【Flash Point】
°C
【Computed Properties】
Molecular Weight:154.1665 [g/mol]
Molecular Formula:C7H10N2O2
XLogP3-AA:-0.1
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:1
Tautomer Count:5
Exact Mass:154.074228
MonoIsotopic Mass:154.074228
Topological Polar Surface Area:58.2
Heavy Atom Count:11
Formal Charge:0
Complexity:235
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:2
Feature 3D Ring Count:1
Effective Rotor Count:2.2
Conformer Sampling RMSD:0.6
CID Conformer Count:6
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