Products for Research Use Only
RegisterLogin

2- (Pyrazin-2-yloxy) benzonitrile

CAT: 0926-WYB72355-01Size: 0.5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-WYB72355-01Size:0.5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1221723-55-2
MDL Number
MFCD14705865
Smiles
C1=CC=C (C (=C1) C#N) OC2=NC=CN=C2
Molecular Formula
C11H7N3O
Molecular Weight
197.19 g/mol
Controlled
No

Chemical Information

2-(Pyrazin-2-yloxy)benzonitrile
CAS Number1221723-55-2
PubChem CID47002532
IUPAC Name2-pyrazin-2-yloxybenzonitrile
Molecular FormulaC11H7N3O
Molecular Weight197.19
XLogP1.4
Topological Polar Surface Area58.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity247
SMILES
C1=CC=C(C(=C1)C#N)OC2=NC=CN=C2
InChI
InChI=1S/C11H7N3O/c12-7-9-3-1-2-4-10(9)15-11-8-13-5-6-14-11/h1-6,8H
InChIKey
MRYVPQGVRXTCRG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Pyrazin-2-yloxy)benzonitrile
CAS: 1221723-55-2
CID: 47002532
Formula: C11H7N3O
MW: 197.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight197.19
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass197.058911855
Monoisotopic Mass197.058911855
Topological Polar Surface Area58.8 Ų
Heavy Atom Count15
Formal Charge0
Complexity247
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
TJB75566-012- (Pyridin-2-yloxy) benzonitrile
FP53345-014- (Pyridin-2-yloxy) benzonitrile
DPA259034- (Pyrimidin-2-yloxy) benzonitrile
NPA18545-013- (Propan-2-yloxy) benzonitrile
LDA12021-014- (Butan-2-yloxy) benzonitrile
XCA50362-013- (Pyrazin-2-yloxy) phenol
YKB289372- (Tetrahydropyran-4-yloxy) benzonitrile
DDA00349-014- (Pyrazin-2-yloxy) phenol
TFA52642-014- (Pyrazin-2-yl) benzonitrile
QCA21156-012- (Prop-2-yn-1-yloxy) benzonitrile

Alternative Products

CatalogName
OR963445-012- (Pyrimidin-2-yloxy) benzonitrile
232686-014- (Pyridin-2-Yloxy) Benzonitrile
OR965738-014- (Pyrimidin-2-yloxy) benzonitrile
OR943093-013- (Propan-2-yloxy) benzonitrile
GTR19252184-012- (Tetrahydropyran-4-yloxy) benzonitrile
sc-2592482- (5-Bromo-pyrimidin-2-yloxy) -benzonitrile
PC1008990-014- (pyridin-3-yloxy) -2- (trifluoromethyl) benzonitrile
sc-2671244- (5-Bromo-pyrimidin-2-yloxy) -benzonitrile
OR1043360-013-Iodo-4- (propan-2-yloxy) benzonitrile
sc-344650A3- (prop-2-yn-1-yloxy) benzonitrile

Popular Products