Home Carboxys tert-butyl 6-oxopiperidine-3-carboxylate

tert-butyl 6-oxopiperidine-3-carboxylate

CAS No.:
1552946-57-2
Catalog Number:
AG01BJ33
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
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Product Description
Catalog Number:
AG01BJ33
Chemical Name:
tert-butyl 6-oxopiperidine-3-carboxylate
CAS Number:
1552946-57-2
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD26016221
IUPAC Name:
tert-butyl 6-oxopiperidine-3-carboxylate
InChI:
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)7-4-5-8(12)11-6-7/h7H,4-6H2,1-3H3,(H,11,12)
InChI Key:
ZWISLQIQFQJVGB-UHFFFAOYSA-N
SMILES:
O=C1CCC(CN1)C(=O)OC(C)(C)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties