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173186-91-9

173186-91-9 | 4-Piperidinone, 3,3-dimethyl-1-(phenylmethyl)-

CAS No: 173186-91-9 Catalog No: AG001YP2 MDL No:MFCD09908040

Product Description

Catalog Number:
AG001YP2
Chemical Name:
4-Piperidinone, 3,3-dimethyl-1-(phenylmethyl)-
CAS Number:
173186-91-9
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
MDL Number:
MFCD09908040
IUPAC Name:
1-benzyl-3,3-dimethylpiperidin-4-one
InChI:
InChI=1S/C14H19NO/c1-14(2)11-15(9-8-13(14)16)10-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3
InChI Key:
YKQMBPQMCWGNDY-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1(C)C)Cc1ccccc1

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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