Home Nitriles 1-acetylazetidine-3-carbonitrile

1-acetylazetidine-3-carbonitrile

CAS No.:
2112395-13-6
Catalog Number:
AG01EJTO
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EJTO
Chemical Name:
1-acetylazetidine-3-carbonitrile
CAS Number:
2112395-13-6
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD31665926
IUPAC Name:
1-acetylazetidine-3-carbonitrile
InChI:
InChI=1S/C6H8N2O/c1-5(9)8-3-6(2-7)4-8/h6H,3-4H2,1H3
InChI Key:
AAQZFAVTUWYUOA-UHFFFAOYSA-N
SMILES:
N#CC1CN(C1)C(=O)C
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties