Home Halogens 2-(benzylsulfanyl)-6-chloropyrazine

2-(benzylsulfanyl)-6-chloropyrazine

CAS No.:
33870-91-6
Catalog Number:
AG019PTA
Molecular Formula:
C11H9ClN2S
Molecular Weight:
236.7206
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Product Description
Catalog Number:
AG019PTA
Chemical Name:
2-(benzylsulfanyl)-6-chloropyrazine
CAS Number:
33870-91-6
Molecular Formula:
C11H9ClN2S
Molecular Weight:
236.7206
MDL Number:
MFCD11618568
IUPAC Name:
2-benzylsulfanyl-6-chloropyrazine
InChI:
InChI=1S/C11H9ClN2S/c12-10-6-13-7-11(14-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
HOHVCKHYQZOUPV-UHFFFAOYSA-N
SMILES:
Clc1cncc(n1)SCc1ccccc1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.017g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.717g/mol
Monoisotopic Mass:
236.017g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties