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Home > Other Heterocycles > 1934963-56-0
1934963-56-0 | 3-oxo-3-{spiro[3.3]heptan-2-yl}propanenitrile
CAS No: 1934963-56-0 Catalog No: AG01FLDI MDL No:
Product Description
Catalog Number:
AG01FLDI
Chemical Name:
3-oxo-3-{spiro[3.3]heptan-2-yl}propanenitrile
CAS Number:
1934963-56-0
IUPAC Name:
3-oxo-3-spiro[3.3]heptan-2-ylpropanenitrile
InChI:
InChI=1S/C10H13NO/c11-5-2-9(12)8-6-10(7-8)3-1-4-10/h8H,1-4,6-7H2
InChI Key:
BIZISPBJTYQKSH-UHFFFAOYSA-N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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