Home Carboxys Ethyl 1-(cyanomethyl)piperidine-3-carboxylate

Ethyl 1-(cyanomethyl)piperidine-3-carboxylate

CAS No.:
946702-02-9
Catalog Number:
AG00J0VG
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG00J0VG
Chemical Name:
Ethyl 1-(cyanomethyl)piperidine-3-carboxylate
CAS Number:
946702-02-9
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
MDL Number:
MFCD09947881
IUPAC Name:
ethyl 1-(cyanomethyl)piperidine-3-carboxylate
InChI:
InChI=1S/C10H16N2O2/c1-2-14-10(13)9-4-3-6-12(8-9)7-5-11/h9H,2-4,6-8H2,1H3
InChI Key:
JWAIADWIXLFQJB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCCN(C1)CC#N
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties