Products for Research Use Only
RegisterLogin

2- (2,4-dichlorophenoxy) acetonitrile

CAT: 0127-OR29562-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-OR29562-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
3956-63-6
MDL Number
MFCD00019826
Purity
95%
Smiles
Clc1ccc(OCC#N)c(Cl)c1

Chemical Information

2,4-Dichlorophenoxyacetonitrile
CAS Number3956-63-6
PubChem CID245811
IUPAC Name2-(2,4-dichlorophenoxy)acetonitrile
Molecular FormulaC8H5Cl2NO
Molecular Weight202.03
XLogP3
Topological Polar Surface Area33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity189
SMILES
C1=CC(=C(C=C1Cl)Cl)OCC#N
InChI
InChI=1S/C8H5Cl2NO/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5H,4H2
InChIKey
QSDMPLNZSJLFRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4-Dichlorophenoxyacetonitrile
CAS: 3956-63-6
CID: 245811
Formula: C8H5Cl2NO
MW: 202.03
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.03
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass200.9748192
Monoisotopic Mass200.9748192
Topological Polar Surface Area33 Ų
Heavy Atom Count12
Formal Charge0
Complexity189
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
OR10981372- (3,4-Dichlorophenoxy) acetonitrile
OR29660-012- (2,6-dichlorophenoxy) acetonitrile
OR29617-012- (3,5-Dichlorophenoxy) acetonitrile
OR238182- (2,4-dichlorophenoxy) benzonitrile
OR121872- (2,4-Dichlorophenoxy) ethanethioamide
OR10995202- (2,4-dichlorophenoxy) aniline
OR1114872- (2,4-Dichlorophenoxy) nicotinonitrile
OR1097708-014- (2,4-Dichlorophenoxy) benzonitrile
OR1044271-012- (2,4-Dichlorophenoxy) ethanamine
OR10210652- (2,4-Dichlorophenoxy) ethanol

Alternative Products

CatalogName
NBA94969-012- (3,4-Dichlorophenoxy) acetonitrile
sc-275485(2,6-Dichlorophenoxy) acetonitrile
PBA96001-012- (2,3-Dichlorophenoxy) acetonitrile
GTR19252207-012- (3,5-Dichlorophenoxy) acetonitrile
KGA98414-012- (4-Acetylphenoxy) acetonitrile
KGA005434-Bromothiophene-2-acetonitrile
XGB03600-012- (4-Aminobenzenesulfonyl) acetonitrile
TJA65795-012- (4-Iodophenoxy) acetonitrile
TN2721(2,4-Dihydroxyphenyl) acetonitrile
413816-012- (4-Iodophenyl) acetonitrile

Popular Products