Home Other Building Blocks tert-butyl 3-(piperidin-3-yl)propanoate

tert-butyl 3-(piperidin-3-yl)propanoate

CAS No.:
1250602-30-2
Catalog Number:
AG01C1XR
Molecular Formula:
C12H23NO2
Molecular Weight:
213.3165
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Product Description
Catalog Number:
AG01C1XR
Chemical Name:
tert-butyl 3-(piperidin-3-yl)propanoate
CAS Number:
1250602-30-2
Molecular Formula:
C12H23NO2
Molecular Weight:
213.3165
MDL Number:
MFCD16084993
IUPAC Name:
tert-butyl 3-piperidin-3-ylpropanoate
InChI:
InChI=1S/C12H23NO2/c1-12(2,3)15-11(14)7-6-10-5-4-8-13-9-10/h10,13H,4-9H2,1-3H3
InChI Key:
KVRUUGQSHWPGOT-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CCC1CCCNC1
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.173g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.321g/mol
Monoisotopic Mass:
213.173g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties