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Home > Other Heterocycles > 1866842-04-7

1866842-04-7

1866842-04-7 | 6-(propan-2-yl)-1-oxaspiro[2.6]nonane-2-carbonitrile

CAS No: 1866842-04-7 Catalog No: AG01C6PM MDL No:MFCD31432255

Product Description

Catalog Number:
AG01C6PM
Chemical Name:
6-(propan-2-yl)-1-oxaspiro[2.6]nonane-2-carbonitrile
CAS Number:
1866842-04-7
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
MDL Number:
MFCD31432255
IUPAC Name:
6-propan-2-yl-1-oxaspiro[2.6]nonane-2-carbonitrile
InChI:
InChI=1S/C12H19NO/c1-9(2)10-4-3-6-12(7-5-10)11(8-13)14-12/h9-11H,3-7H2,1-2H3
InChI Key:
WQMGNFMECNQBCW-UHFFFAOYSA-N
SMILES:
N#CC1OC21CCCC(CC2)C(C)C

Properties

Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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