Home Carboxys tert-butyl 4-(but-2-enoyl)piperidine-1-carboxylate

tert-butyl 4-(but-2-enoyl)piperidine-1-carboxylate

CAS No.:
2138806-71-8
Catalog Number:
AG01EM6E
Molecular Formula:
C14H23NO3
Molecular Weight:
253.3373
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Product Description
Catalog Number:
AG01EM6E
Chemical Name:
tert-butyl 4-(but-2-enoyl)piperidine-1-carboxylate
CAS Number:
2138806-71-8
Molecular Formula:
C14H23NO3
Molecular Weight:
253.3373
MDL Number:
MFCD31664975
IUPAC Name:
tert-butyl 4-[(E)-but-2-enoyl]piperidine-1-carboxylate
InChI:
InChI=1S/C14H23NO3/c1-5-6-12(16)11-7-9-15(10-8-11)13(17)18-14(2,3)4/h5-6,11H,7-10H2,1-4H3/b6-5+
InChI Key:
DDSQDOFHRREAHJ-AATRIKPKSA-N
SMILES:
CC=CC(=O)C1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
253.168g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.342g/mol
Monoisotopic Mass:
253.168g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties