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2,6-Dichloroquinoxaline

CAT: 0572-TRC-D436540-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D436540-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18671-97-1
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
Clc1ccc2nc(Cl)cnc2c1
Molecular Formula
C8H4Cl2N2
Molecular Weight
199.04
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2,6-Dichloroquinoxaline
CAS Number18671-97-1
PubChem CID87748
IUPAC Name2,6-dichloroquinoxaline
Molecular FormulaC8H4Cl2N2
Molecular Weight199.03
XLogP2.9
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity165
SMILES
C1=CC2=NC(=CN=C2C=C1Cl)Cl
InChI
InChI=1S/C8H4Cl2N2/c9-5-1-2-6-7(3-5)11-4-8(10)12-6/h1-4H
InChIKey
WFOKVKYNVKVWFK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Dichloroquinoxaline
CAS: 18671-97-1
CID: 87748
Formula: C8H4Cl2N2
MW: 199.03
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight199.03
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass197.9751535
Monoisotopic Mass197.9751535
Topological Polar Surface Area25.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity165
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