4-(3-formylphenoxy)benzonitrile

4-(3-formylphenoxy)benzonitrile

CAS: 90178-72-6

Formula: C14H9NO2

SMILES: O=CC1=CC=CC(OC2=CC=C(C=C2)C#N)=C1

IUPAC: 4-(3-formylphenoxy)benzonitrile

InChI: InChI=1S/C14H9NO2/c15-9-11-4-6-13(7-5-11)17-14-3-1-2-12(8-14)10-16/h1-8,10H

Composition: C (75.33%), H (4.06%), N (6.27%), O (14.33%)

Molar Mass: 223.231

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	223.063328534
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	ZNFFJDNCDHKHEJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.6
Topological Polar Surface Area	50.09
Polarizability	24.38
Ring Count	2
Rotatable Bond Count	3

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