Home Nitriles 3-(2-fluoro-4-methoxyphenyl)propanenitrile

3-(2-fluoro-4-methoxyphenyl)propanenitrile

CAS No.:
1803727-00-5
Catalog Number:
AG00I01V
Molecular Formula:
C10H10FNO
Molecular Weight:
179.1909
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00I01V
Chemical Name:
3-(2-fluoro-4-methoxyphenyl)propanenitrile
CAS Number:
1803727-00-5
Molecular Formula:
C10H10FNO
Molecular Weight:
179.1909
MDL Number:
MFCD28905330
IUPAC Name:
3-(2-fluoro-4-methoxyphenyl)propanenitrile
InChI:
InChI=1S/C10H10FNO/c1-13-9-5-4-8(3-2-6-12)10(11)7-9/h4-5,7H,2-3H2,1H3
InChI Key:
SDJKAWBLMBKEKQ-UHFFFAOYSA-N
SMILES:
N#CCCc1ccc(cc1F)OC
Properties
Complexity:
198  
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:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties