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390766-89-9 | 4-Imidazolidinone,2-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-, (2R,5R)-
CAS No: 390766-89-9 Catalog No: AG0076KZ MDL No:MFCD08276842
Product Description
Catalog Number:
AG0076KZ
Chemical Name:
4-Imidazolidinone,2-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-, (2R,5R)-
CAS Number:
390766-89-9
Molecular Formula:
C15H22N2O
Molecular Weight:
246.3480
MDL Number:
MFCD08276842
IUPAC Name:
(2R,5R)-5-benzyl-2-tert-butyl-3-methylimidazolidin-4-one
InChI:
InChI=1S/C15H22N2O/c1-15(2,3)14-16-12(13(18)17(14)4)10-11-8-6-5-7-9-11/h5-9,12,14,16H,10H2,1-4H3/t12-,14-/m1/s1
InChI Key:
SKHPYKHVYFTIOI-TZMCWYRMSA-N
SMILES:
CN1C(=O)[C@H](N[C@H]1C(C)(C)C)Cc1ccccc1
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
246.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.354g/mol
Monoisotopic Mass:
246.173g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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