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1159816-36-0

1159816-36-0 | Pyrazine, 2-bromo-5-(1,1-dimethylethoxy)-

CAS No: 1159816-36-0 Catalog No: AG000HAK MDL No:MFCD11223437

Product Description

Catalog Number:
AG000HAK
Chemical Name:
Pyrazine, 2-bromo-5-(1,1-dimethylethoxy)-
CAS Number:
1159816-36-0
Molecular Formula:
C8H11BrN2O
Molecular Weight:
231.0897
MDL Number:
MFCD11223437
IUPAC Name:
2-bromo-5-[(2-methylpropan-2-yl)oxy]pyrazine
InChI:
InChI=1S/C8H11BrN2O/c1-8(2,3)12-7-5-10-6(9)4-11-7/h4-5H,1-3H3
InChI Key:
VQXSMBFFWDPCNI-UHFFFAOYSA-N
SMILES:
CC(Oc1ncc(nc1)Br)(C)C

Properties

Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.005g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.093g/mol
Monoisotopic Mass:
230.005g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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