Home Halogens 3-bromo-4-tert-butylpyridine

3-bromo-4-tert-butylpyridine

CAS No.:
90731-98-9
Catalog Number:
AG01BCA6
Molecular Formula:
C9H12BrN
Molecular Weight:
214.1023
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Product Description
Catalog Number:
AG01BCA6
Chemical Name:
3-bromo-4-tert-butylpyridine
CAS Number:
90731-98-9
Molecular Formula:
C9H12BrN
Molecular Weight:
214.1023
MDL Number:
MFCD22379690
IUPAC Name:
3-bromo-4-tert-butylpyridine
InChI:
InChI=1S/C9H12BrN/c1-9(2,3)7-4-5-11-6-8(7)10/h4-6H,1-3H3
InChI Key:
BQAWPKLIAUMEBD-UHFFFAOYSA-N
SMILES:
Brc1cnccc1C(C)(C)C
Properties
Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.106g/mol
Monoisotopic Mass:
213.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties