Home Nitriles 1,6-Dioxaspiro[2.5]octane-2-carbonitrile

1,6-Dioxaspiro[2.5]octane-2-carbonitrile

CAS No.:
883442-47-5
Catalog Number:
AG00H43C
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$164
- +
250mg
95%
In Stock USA
United States
$273
- +
1g
95%
In Stock USA
United States
$546
- +
Product Description
Catalog Number:
AG00H43C
Chemical Name:
1,6-Dioxaspiro[2.5]octane-2-carbonitrile
CAS Number:
883442-47-5
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD20485154
IUPAC Name:
1,6-dioxaspiro[2.5]octane-2-carbonitrile
InChI:
InChI=1S/C7H9NO2/c8-5-6-7(10-6)1-3-9-4-2-7/h6H,1-4H2
InChI Key:
IPHRJNDSVHURSO-UHFFFAOYSA-N
SMILES:
N#CC1OC21CCOCC2
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties