Home Nitriles 3-oxo-3-(2,2,3,3-tetramethylcyclopropyl)propanenitrile

3-oxo-3-(2,2,3,3-tetramethylcyclopropyl)propanenitrile

CAS No.:
1499692-62-4
Catalog Number:
AG01AMXF
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
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Product Description
Catalog Number:
AG01AMXF
Chemical Name:
3-oxo-3-(2,2,3,3-tetramethylcyclopropyl)propanenitrile
CAS Number:
1499692-62-4
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
MDL Number:
MFCD21783499
IUPAC Name:
3-oxo-3-(2,2,3,3-tetramethylcyclopropyl)propanenitrile
InChI:
InChI=1S/C10H15NO/c1-9(2)8(10(9,3)4)7(12)5-6-11/h8H,5H2,1-4H3
InChI Key:
XZIDYFURFYSFBG-UHFFFAOYSA-N
SMILES:
N#CCC(=O)C1C(C1(C)C)(C)C
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties