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1142197-19-0 | Pyridine, 2-bromo-5-(1,1-dimethylethyl)-
CAS No: 1142197-19-0 Catalog No: AG000AU9 MDL No:MFCD11869554
Product Description
Catalog Number:
AG000AU9
Chemical Name:
Pyridine, 2-bromo-5-(1,1-dimethylethyl)-
CAS Number:
1142197-19-0
Molecular Formula:
C9H12BrN
Molecular Weight:
214.1023
MDL Number:
MFCD11869554
IUPAC Name:
2-bromo-5-tert-butylpyridine
InChI:
InChI=1S/C9H12BrN/c1-9(2,3)7-4-5-8(10)11-6-7/h4-6H,1-3H3
InChI Key:
IOGKQDRGOUALAS-UHFFFAOYSA-N
SMILES:
Brc1ccc(cn1)C(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:
3.5
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