Products for Research Use Only
RegisterLogin

2- (Phenoxymethyl) benzonitrile

CAT: 0926-TGA97154Size: 2.5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-TGA97154Size:2.5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
168971-54-8
MDL Number
MFCD08070461
Smiles
C1=CC=C (C=C1) OCC2=CC=CC=C2C#N
Molecular Formula
C14H11NO
Molecular Weight
209.24 g/mol
Controlled
No

Chemical Information

2-(Phenoxymethyl)benzonitrile
CAS Number168971-54-8
PubChem CID6463091
IUPAC Name2-(phenoxymethyl)benzonitrile
Molecular FormulaC14H11NO
Molecular Weight209.24
XLogP3.1
Topological Polar Surface Area33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity249
SMILES
C1=CC=C(C=C1)OCC2=CC=CC=C2C#N
InChI
InChI=1S/C14H11NO/c15-10-12-6-4-5-7-13(12)11-16-14-8-2-1-3-9-14/h1-9H,11H2
InChIKey
RFZUYPHTPWGIJU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Phenoxymethyl)benzonitrile
CAS: 168971-54-8
CID: 6463091
Formula: C14H11NO
MW: 209.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight209.24
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass209.084063974
Monoisotopic Mass209.084063974
Topological Polar Surface Area33 Ų
Heavy Atom Count16
Formal Charge0
Complexity249
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
DDA58441-012- (Phenoxymethyl) aniline
HHC68062-013-[4- (1,2,3,6-Tetrahydropyridin-4-yl) phenoxymethyl]benzonitrile hydrochloride
EHC34096-012- (Phenoxymethyl) morpholine hydrochloride
BCA76551-012- ((Phenoxymethyl) sulfonyl) aniline
ZGA21376-01(2S) -2- (Phenoxymethyl) pyrrolidine
KCB90418-015- (Phenoxymethyl) furan-2-carbaldehyde
XWB73692-01[2- (Phenoxymethyl) phenyl]methanamine hydrochloride
HWB08844-012-Methyl-3- (phenoxymethyl) aniline
DXC60072-012,2-Dimethyl-6- (phenoxymethyl) morpholine
ZGA21352-01(2S) -2- (Phenoxymethyl) pyrrolidine hydrochloride

Alternative Products

CatalogName
OR86502- (Phenoxymethyl) benzonitrile
OR75366-013- (Phenoxymethyl) benzonitrile
OR78477-014-[2- (4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl) -phenoxymethyl]-benzonitrile
OR84398-013-[2- (4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl) -phenoxymethyl]-benzonitrile
TRC-P318615-10G2-(Phenoxymethyl)oxirane
OR10801703- (Phenoxymethyl) benzaldehyde
OR10890234- (Phenoxymethyl) benzaldehyde
OR86782- (Phenoxymethyl) benzaldehyde
sc-340378A2- (phenoxymethyl) aniline
GTR19252239-013- (Phenoxymethyl) aniline

Popular Products