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(5S)-5-benzyl-2,2,3-trimethylimidazolidin-4-one hydrochloride

(5S)-5-benzyl-2,2,3-trimethylimidazolidin-4-one hydrochloride

CAS: 278173-23-2

Formula: C13H19ClN2O

SMILES: Cl.CN1C(=O)[C@H](CC2=CC=CC=C2)NC1(C)C

IUPAC: (5S)-5-benzyl-2,2,3-trimethylimidazolidin-4-one hydrochloride

InChI: InChI=1S/C13H18N2O.ClH/c1-13(2)14-11(12(16)15(13)3)9-10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/t11-;/m0./s1

Composition: C (61.29%), H (7.52%), Cl (13.92%), N (11.00%), O (6.28%)

Molar Mass: 254.76

Atom Count: 36

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 254.1185909
Formal Charge 0
FSP3 0.46
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YIYFEXGDFJLJGM-MERQFXBCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.21
Topological Polar Surface Area 32.34
Polarizability 25.23
Ring Count 2
Rotatable Bond Count 2

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98% <6 Days 278173-23-2 $50.60-$491.05$50.60$118.45$491.05
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97% <5 Days 278173-23-2 $78.18-$736.42$78.18$95.84$192.93$736.42
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