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52211-04-8 | 1-Methyl-3-(piperidin-4-yl)iMidazolidin-2-one
CAS No: 52211-04-8 Catalog No: AG00DLDC MDL No:MFCD20502046
Product Description
Catalog Number:
AG00DLDC
Chemical Name:
1-Methyl-3-(piperidin-4-yl)iMidazolidin-2-one
CAS Number:
52211-04-8
Molecular Formula:
C9H17N3O
Molecular Weight:
183.2508
MDL Number:
MFCD20502046
IUPAC Name:
1-methyl-3-piperidin-4-ylimidazolidin-2-one
InChI:
InChI=1S/C9H17N3O/c1-11-6-7-12(9(11)13)8-2-4-10-5-3-8/h8,10H,2-7H2,1H3
InChI Key:
DWFGEKHJKFNGNW-UHFFFAOYSA-N
SMILES:
O=C1N(C)CCN1C1CCNCC1
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.137g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.255g/mol
Monoisotopic Mass:
183.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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