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Home > Other Heterocycles > 74650-13-8
74650-13-8 | 3-Azabicyclo[3.1.0]hexane-2-carbonitrile,3-acetyl-
CAS No: 74650-13-8 Catalog No: AG005J1S MDL No:
Product Description
Catalog Number:
AG005J1S
Chemical Name:
3-Azabicyclo[3.1.0]hexane-2-carbonitrile,3-acetyl-
CAS Number:
74650-13-8
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
IUPAC Name:
3-acetyl-3-azabicyclo[3.1.0]hexane-2-carbonitrile
InChI:
InChI=1S/C8H10N2O/c1-5(11)10-4-6-2-7(6)8(10)3-9/h6-8H,2,4H2,1H3
InChI Key:
HJFUUJDOMWSXBT-UHFFFAOYSA-N
SMILES:
N#CC1C2CC2CN1C(=O)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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