Home Halogens 2-tert-butyl-5-chloropyrazine

2-tert-butyl-5-chloropyrazine

CAS No.:
1196155-92-6
Catalog Number:
AG01B7VG
Molecular Formula:
C8H11ClN2
Molecular Weight:
170.6393
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Product Description
Catalog Number:
AG01B7VG
Chemical Name:
2-tert-butyl-5-chloropyrazine
CAS Number:
1196155-92-6
Molecular Formula:
C8H11ClN2
Molecular Weight:
170.6393
MDL Number:
MFCD13190310
IUPAC Name:
2-tert-butyl-5-chloropyrazine
InChI:
InChI=1S/C8H11ClN2/c1-8(2,3)6-4-11-7(9)5-10-6/h4-5H,1-3H3
InChI Key:
LXMMDWCXWMPCOQ-UHFFFAOYSA-N
SMILES:
CC(c1ncc(nc1)Cl)(C)C
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.64g/mol
Monoisotopic Mass:
170.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties