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Cyclobutylacetonitrile

CAS No.:
4426-03-3
Catalog Number:
AG00DD1J
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
Product Description
Catalog Number:
AG00DD1J
Chemical Name:
Cyclobutylacetonitrile
CAS Number:
4426-03-3
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
MDL Number:
MFCD09038154
IUPAC Name:
2-cyclobutylacetonitrile
InChI:
InChI=1S/C6H9N/c7-5-4-6-2-1-3-6/h6H,1-4H2
InChI Key:
BWFYLNLITXLIGS-UHFFFAOYSA-N
SMILES:
N#CCC1CCC1
Properties
Complexity:
94  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.073g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
95.145g/mol
Monoisotopic Mass:
95.073g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties