2-[hydroxy(4-phenoxyphenyl)methylidene]propanedinitrile

2-[hydroxy(4-phenoxyphenyl)methylidene]propanedinitrile

CAS: 330792-68-2

Formula: C16H10N2O2

SMILES: OC(=C(C#N)C#N)C1=CC=C(OC2=CC=CC=C2)C=C1

IUPAC: 2-[hydroxy(4-phenoxyphenyl)methylidene]propanedinitrile

InChI: InChI=1S/C16H10N2O2/c17-10-13(11-18)16(19)12-6-8-15(9-7-12)20-14-4-2-1-3-5-14/h1-9,19H

Composition: C (73.27%), H (3.84%), N (10.68%), O (12.20%)

Molar Mass: 262.268

Atom Count: 30

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	262.07422757
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	MWTPPIZIKZHMSK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.23
Topological Polar Surface Area	77.04
Polarizability	28.07
Ring Count	2
Rotatable Bond Count	3

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