Home Carboxys Ethyl 1-cyanocyclopentane-1-carboxylate

Ethyl 1-cyanocyclopentane-1-carboxylate

CAS No.:
28247-14-5
Catalog Number:
AG00BGY0
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$119
- +
5g
95%
In Stock USA
United States
$413
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00BGY0
Chemical Name:
Ethyl 1-cyanocyclopentane-1-carboxylate
CAS Number:
28247-14-5
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
MDL Number:
MFCD00019291
IUPAC Name:
ethyl 1-cyanocyclopentane-1-carboxylate
InChI:
InChI=1S/C9H13NO2/c1-2-12-8(11)9(7-10)5-3-4-6-9/h2-6H2,1H3
InChI Key:
VPWIERPHIAKPOH-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCCC1)C#N
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties