2,3-bis(4-methoxyphenyl)propanenitrile

2,3-bis(4-methoxyphenyl)propanenitrile

CAS: 72035-46-2

Formula: C17H17NO2

SMILES: COC1=CC=C(CC(C#N)C2=CC=C(OC)C=C2)C=C1

IUPAC: 2,3-bis(4-methoxyphenyl)propanenitrile

InChI: InChI=1/C17H17NO2/c1-19-16-7-3-13(4-8-16)11-15(12-18)14-5-9-17(20-2)10-6-14/h3-10,15H,11H2,1-2H3

Composition: C (76.38%), H (6.41%), N (5.24%), O (11.97%)

Molar Mass: 267.328

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	267.125928791
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WXTLYNYQEYBSHU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.54
Topological Polar Surface Area	42.25
Polarizability	30.33
Ring Count	2
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	72035-46-2		$93.31-$199.24$93.31$199.24