Home Nitriles 3-Methoxy-4-(trifluoromethyl)benzonitrile

3-Methoxy-4-(trifluoromethyl)benzonitrile

CAS No.:
447-93-8
Catalog Number:
AG00DIVO
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DIVO
Chemical Name:
3-Methoxy-4-(trifluoromethyl)benzonitrile
CAS Number:
447-93-8
MDL Number:
MFCD13185685
IUPAC Name:
3-methoxy-4-(trifluoromethyl)benzonitrile
InChI:
InChI=1S/C9H6F3NO/c1-14-8-4-6(5-13)2-3-7(8)9(10,11)12/h2-4H,1H3
InChI Key:
QASUCJMIPAXDOB-UHFFFAOYSA-N
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.148g/mol
Monoisotopic Mass:
201.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties