Home Nitriles 2,3-Dihydro-1,4-benzodioxine-5-carbonitrile

2,3-Dihydro-1,4-benzodioxine-5-carbonitrile

CAS No.:
148703-14-4
Catalog Number:
AG001L4D
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG001L4D
Chemical Name:
2,3-Dihydro-1,4-benzodioxine-5-carbonitrile
CAS Number:
148703-14-4
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD01116986
IUPAC Name:
2,3-dihydro-1,4-benzodioxine-5-carbonitrile
InChI:
InChI=1S/C9H7NO2/c10-6-7-2-1-3-8-9(7)12-5-4-11-8/h1-3H,4-5H2
InChI Key:
WNNQCWLSQDNACP-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1OCCO2
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties