4-(dimethoxymethyl)benzonitrile

4-(dimethoxymethyl)benzonitrile

CAS: 90921-71-4

Formula: C10H11NO2

SMILES: COC(OC)C1=CC=C(C=C1)C#N

IUPAC: 4-(dimethoxymethyl)benzonitrile

InChI: InChI=1S/C10H11NO2/c1-12-10(13-2)9-5-3-8(7-11)4-6-9/h3-6,10H,1-2H3

Composition: C (67.78%), H (6.26%), N (7.90%), O (18.06%)

Molar Mass: 177.203

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	177.078978598
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KAIKLOZUJNGBNP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.13
Topological Polar Surface Area	42.25
Polarizability	19.06
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	90921-71-4		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	90921-71-4		$296.01-$518.54$296.01$518.54