Name: Name:2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile
Brand: Angene
SKU: AG019W8S
Rating: 90 (10 reviews)

2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile

CAS No.:

1193388-12-3

Catalog Number:

AG019W8S

Molecular Formula:

C11H10F3NO2

Molecular Weight:

245.1978

Catalog Number:

AG019W8S

Chemical Name:

2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile

CAS Number:

1193388-12-3

Molecular Formula:

C11H10F3NO2

Molecular Weight:

245.1978

MDL Number:

MFCD12912919

IUPAC Name:

2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile

InChI:

InChI=1S/C11H10F3NO2/c1-16-10-6-8(4-5-15)2-3-9(10)17-7-11(12,13)14/h2-3,6H,4,7H2,1H3

InChI Key:

WCWNLAFKRNRWCD-UHFFFAOYSA-N

SMILES:

N#CCc1ccc(c(c1)OC)OCC(F)(F)F

Complexity:

284

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.066g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.201g/mol

Monoisotopic Mass:

245.066g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3