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20785-46-0 | 4-Piperidinone, 1-(2-propen-1-yl)-
CAS No: 20785-46-0 Catalog No: AG002JCF MDL No:MFCD09152746
Product Description
Catalog Number:
AG002JCF
Chemical Name:
4-Piperidinone, 1-(2-propen-1-yl)-
CAS Number:
20785-46-0
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD09152746
IUPAC Name:
1-prop-2-enylpiperidin-4-one
InChI:
InChI=1S/C8H13NO/c1-2-5-9-6-3-8(10)4-7-9/h2H,1,3-7H2
InChI Key:
IFGPIJRMICXHER-UHFFFAOYSA-N
SMILES:
C=CCN1CCC(=O)CC1
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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