Name: Name:Benzeneacetonitrile, 4-chloro-α-(phenylmethylene)-, (E)- (9CI)
Brand: Angene
SKU: AG001WI7
Rating: 90 (10 reviews)

Benzeneacetonitrile, 4-chloro-α-(phenylmethylene)-, (E)- (9CI)

CAS No.:

16610-81-4

Catalog Number:

AG001WI7

Molecular Formula:

C15H10ClN

Molecular Weight:

239.6996

Catalog Number:

AG001WI7

Chemical Name:

Benzeneacetonitrile, 4-chloro-α-(phenylmethylene)-, (E)- (9CI)

CAS Number:

16610-81-4

Molecular Formula:

C15H10ClN

Molecular Weight:

239.6996

MDL Number:

MFCD00082873

IUPAC Name:

(E)-2-(4-chlorophenyl)-3-phenylprop-2-enenitrile

InChI:

InChI=1S/C15H10ClN/c16-15-8-6-13(7-9-15)14(11-17)10-12-4-2-1-3-5-12/h1-10H/b14-10-

InChI Key:

JJGLLZWUWIKTAG-UVTDQMKNSA-N

SMILES:

N#C/C(=C/c1ccccc1)/c1ccc(cc1)Cl

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.05g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.702g/mol

Monoisotopic Mass:

239.05g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3