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1018555-33-3 | 1-Propanone, 1-[4-(aminomethyl)-1-piperidinyl]-2,2-dimethyl-
CAS No: 1018555-33-3 Catalog No: AG0005QR MDL No:
Product Description
Catalog Number:
AG0005QR
Chemical Name:
1-Propanone, 1-[4-(aminomethyl)-1-piperidinyl]-2,2-dimethyl-
CAS Number:
1018555-33-3
Molecular Formula:
C11H22N2O
Molecular Weight:
198.3052
IUPAC Name:
1-[4-(aminomethyl)piperidin-1-yl]-2,2-dimethylpropan-1-one
InChI:
InChI=1S/C11H22N2O/c1-11(2,3)10(14)13-6-4-9(8-12)5-7-13/h9H,4-8,12H2,1-3H3
InChI Key:
UXGDCELHOSVFIM-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1)C(=O)C(C)(C)C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.173g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.31g/mol
Monoisotopic Mass:
198.173g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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