Name: Name:2-(5,6-difluoro-3-oxo-2,3-dihydro-1H-inden-1-ylidene)malononitrile
Brand: Angene
SKU: AG01DKEU
Rating: 90 (10 reviews)

2-(5,6-difluoro-3-oxo-2,3-dihydro-1H-inden-1-ylidene)malononitrile

CAS No.:

2083617-82-5

Catalog Number:

AG01DKEU

Molecular Formula:

C12H4F2N2O

Molecular Weight:

230.1698

Catalog Number:

AG01DKEU

Chemical Name:

2-(5,6-difluoro-3-oxo-2,3-dihydro-1H-inden-1-ylidene)malononitrile

CAS Number:

2083617-82-5

Molecular Formula:

C12H4F2N2O

Molecular Weight:

230.1698

MDL Number:

MFCD31631729

IUPAC Name:

2-(5,6-difluoro-3-oxoinden-1-ylidene)propanedinitrile

InChI:

InChI=1S/C12H4F2N2O/c13-10-1-8-7(6(4-15)5-16)3-12(17)9(8)2-11(10)14/h1-2H,3H2

InChI Key:

FKMLTPDJPCYVHT-UHFFFAOYSA-N

SMILES:

N#CC(=C1CC(=O)c2c1cc(F)c(c2)F)C#N

Complexity:

475

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.029g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.174g/mol

Monoisotopic Mass:

230.029g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3