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Home > Imidazoles > 1198795-15-1
1198795-15-1 | 1-(imidazolidin-1-yl)propan-1-one
CAS No: 1198795-15-1 Catalog No: AG01C442 MDL No:MFCD19227842
Product Description
Catalog Number:
AG01C442
Chemical Name:
1-(imidazolidin-1-yl)propan-1-one
CAS Number:
1198795-15-1
Molecular Formula:
C6H12N2O
Molecular Weight:
128.1723
MDL Number:
MFCD19227842
IUPAC Name:
1-imidazolidin-1-ylpropan-1-one
InChI:
InChI=1S/C6H12N2O/c1-2-6(9)8-4-3-7-5-8/h7H,2-5H2,1H3
InChI Key:
YXTPQCGLMDHWMJ-UHFFFAOYSA-N
SMILES:
CCC(=O)N1CNCC1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.095g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.175g/mol
Monoisotopic Mass:
128.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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