Home Other Building Blocks 4-tert-butylpiperidin-2-one

4-tert-butylpiperidin-2-one

CAS No.:
50549-20-7
Catalog Number:
AG01AGAI
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
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Product Description
Catalog Number:
AG01AGAI
Chemical Name:
4-tert-butylpiperidin-2-one
CAS Number:
50549-20-7
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
MDL Number:
MFCD24550425
IUPAC Name:
4-tert-butylpiperidin-2-one
InChI:
InChI=1S/C9H17NO/c1-9(2,3)7-4-5-10-8(11)6-7/h7H,4-6H2,1-3H3,(H,10,11)
InChI Key:
WCAYVLDBIHEGGQ-UHFFFAOYSA-N
SMILES:
O=C1NCCC(C1)C(C)(C)C
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.131g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.241g/mol
Monoisotopic Mass:
155.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties