Home Nitriles 5-Fluoro-2-isopropoxybenzonitrile

5-Fluoro-2-isopropoxybenzonitrile

CAS No.:
1158506-01-4
Catalog Number:
AG00HD36
Molecular Formula:
C10H10FNO
Molecular Weight:
179.1909
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$169
- +
5g
96%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00HD36
Chemical Name:
5-Fluoro-2-isopropoxybenzonitrile
CAS Number:
1158506-01-4
Molecular Formula:
C10H10FNO
Molecular Weight:
179.1909
MDL Number:
MFCD15201676
IUPAC Name:
5-fluoro-2-propan-2-yloxybenzonitrile
InChI:
InChI=1S/C10H10FNO/c1-7(2)13-10-4-3-9(11)5-8(10)6-12/h3-5,7H,1-2H3
InChI Key:
DBGKNXAEJDEUPX-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)ccc1OC(C)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.194g/mol
Monoisotopic Mass:
179.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties