Home Carboxys (E)-tert-butyl 4-(5-methoxy-5-oxopent-3-en-1-yl)piperidine-1-carboxylate

(E)-tert-butyl 4-(5-methoxy-5-oxopent-3-en-1-yl)piperidine-1-carboxylate

CAS No.:
2102414-88-8
Catalog Number:
AG01DJC6
Molecular Formula:
C16H27NO4
Molecular Weight:
297.3899
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Product Description
Catalog Number:
AG01DJC6
Chemical Name:
(E)-tert-butyl 4-(5-methoxy-5-oxopent-3-en-1-yl)piperidine-1-carboxylate
CAS Number:
2102414-88-8
Molecular Formula:
C16H27NO4
Molecular Weight:
297.3899
IUPAC Name:
tert-butyl 4-(5-methoxy-5-oxopent-3-enyl)piperidine-1-carboxylate
InChI:
InChI=1S/C16H27NO4/c1-16(2,3)21-15(19)17-11-9-13(10-12-17)7-5-6-8-14(18)20-4/h6,8,13H,5,7,9-12H2,1-4H3
InChI Key:
GMRWKDNURRIYOZ-UHFFFAOYSA-N
SMILES:
COC(=O)/C=C/CCC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.194g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.395g/mol
Monoisotopic Mass:
297.194g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3  
Properties