(2E)-2-(1H-1,3-benzodiazol-2-yl)-3-phenylprop-2-enenitrile

(2E)-2-(1H-1,3-benzodiazol-2-yl)-3-phenylprop-2-enenitrile

Formula: C16H11N3

SMILES: N#CC(=C/C1=CC=CC=C1)C1=NC2=CC=CC=C2N1

IUPAC: (2E)-2-(1H-1,3-benzodiazol-2-yl)-3-phenylprop-2-enenitrile

InChI: InChI=1S/C16H11N3/c17-11-13(10-12-6-2-1-3-7-12)16-18-14-8-4-5-9-15(14)19-16/h1-10H,(H,18,19)/b13-10+

Composition: C (78.35%), H (4.52%), N (17.13%)

Molar Mass: 245.285

Atom Count: 30

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	245.095297366
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YASZPDZHYPEICO-JLHYYAGUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.88
Topological Polar Surface Area	52.47
Polarizability	29.43
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H11N3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00