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Home > Other Heterocycles > 1864572-35-9

1864572-35-9

1864572-35-9 | 7-methyl-4-(propan-2-yl)-1-oxaspiro[2.5]octane-2-carbonitrile

CAS No: 1864572-35-9 Catalog No: AG01C6PN MDL No:MFCD31432256

Product Description

Catalog Number:
AG01C6PN
Chemical Name:
7-methyl-4-(propan-2-yl)-1-oxaspiro[2.5]octane-2-carbonitrile
CAS Number:
1864572-35-9
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
MDL Number:
MFCD31432256
IUPAC Name:
7-methyl-4-propan-2-yl-1-oxaspiro[2.5]octane-2-carbonitrile
InChI:
InChI=1S/C12H19NO/c1-8(2)10-5-4-9(3)6-12(10)11(7-13)14-12/h8-11H,4-6H2,1-3H3
InChI Key:
IKZQTOCBQOSQKK-UHFFFAOYSA-N
SMILES:
N#CC1OC21CC(C)CCC2C(C)C

Properties

Complexity:
277  
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:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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