2-[3-(benzyloxy)phenyl]-2-methylpropanenitrile

2-[3-(benzyloxy)phenyl]-2-methylpropanenitrile

Formula: C17H17NO

SMILES: CC(C)(C#N)C1=CC(OCC2=CC=CC=C2)=CC=C1

IUPAC: 2-[3-(benzyloxy)phenyl]-2-methylpropanenitrile

InChI: InChI=1S/C17H17NO/c1-17(2,13-18)15-9-6-10-16(11-15)19-12-14-7-4-3-5-8-14/h3-11H,12H2,1-2H3

Composition: C (81.24%), H (6.82%), N (5.57%), O (6.37%)

Molar Mass: 251.329

Atom Count: 36

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	251.131014171
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	IHDJVSQFPAEOLY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.5
Topological Polar Surface Area	33.02
Polarizability	29.67
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C17H17NO		Quote Only