Home Halogens 4-bromo-2-tert-butylpyrimidine

4-bromo-2-tert-butylpyrimidine

CAS No.:
1142195-70-7
Catalog Number:
AG01A6JX
Molecular Formula:
C8H11BrN2
Molecular Weight:
215.0903
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Product Description
Catalog Number:
AG01A6JX
Chemical Name:
4-bromo-2-tert-butylpyrimidine
CAS Number:
1142195-70-7
Molecular Formula:
C8H11BrN2
Molecular Weight:
215.0903
MDL Number:
MFCD11869449
IUPAC Name:
4-bromo-2-tert-butylpyrimidine
InChI:
InChI=1S/C8H11BrN2/c1-8(2,3)7-10-5-4-6(9)11-7/h4-5H,1-3H3
InChI Key:
XUJUVKJZXXPNFM-UHFFFAOYSA-N
SMILES:
CC(c1nccc(n1)Br)(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:
214.011g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.094g/mol
Monoisotopic Mass:
214.011g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties