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Home Carboxys tert-Butyl 3-(2-cyanoethyl)-4-oxopiperidine-1-carboxylate

tert-Butyl 3-(2-cyanoethyl)-4-oxopiperidine-1-carboxylate

CAS No.:
616875-89-9
Catalog Number:
AG00IAWL
Molecular Formula:
C13H20N2O3
Molecular Weight:
252.3095
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$70
- +
250mg
95%
In Stock USA
United States
$128
- +
1g
95%
In Stock USA
United States
$255
- +
5g
95%
In Stock USA
United States
$763
- +
Product Description
Catalog Number:
AG00IAWL
Chemical Name:
tert-Butyl 3-(2-cyanoethyl)-4-oxopiperidine-1-carboxylate
CAS Number:
616875-89-9
Molecular Formula:
C13H20N2O3
Molecular Weight:
252.3095
MDL Number:
MFCD28991780
IUPAC Name:
tert-butyl 3-(2-cyanoethyl)-4-oxopiperidine-1-carboxylate
InChI:
InChI=1S/C13H20N2O3/c1-13(2,3)18-12(17)15-8-6-11(16)10(9-15)5-4-7-14/h10H,4-6,8-9H2,1-3H3
InChI Key:
HWRUOYPXTIUDPV-UHFFFAOYSA-N
SMILES:
N#CCCC1CN(CCC1=O)C(=O)OC(C)(C)C
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.147g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.314g/mol
Monoisotopic Mass:
252.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties