Home Nitriles 2-(3-Oxocyclobutyl)acetonitrile

2-(3-Oxocyclobutyl)acetonitrile

CAS No.:
2007916-61-0
Catalog Number:
AG002CYN
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$241
- +
1g
97%
1 week
United States
$644
- +
Product Description
Catalog Number:
AG002CYN
Chemical Name:
2-(3-Oxocyclobutyl)acetonitrile
CAS Number:
2007916-61-0
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
MDL Number:
MFCD30003024
IUPAC Name:
2-(3-oxocyclobutyl)acetonitrile
InChI:
InChI=1S/C6H7NO/c7-2-1-5-3-6(8)4-5/h5H,1,3-4H2
InChI Key:
PZUCMMIBKLVHSP-UHFFFAOYSA-N
SMILES:
N#CCC1CC(=O)C1
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties