5-bromo-2-tert-butylpyridine

5-bromo-2-tert-butylpyridine

CAS: 39919-58-9

Formula: C9H12BrN

SMILES: CC(C)(C)C1=CC=C(Br)C=N1

IUPAC: 5-bromo-2-tert-butylpyridine

InChI: InChI=1S/C9H12BrN/c1-9(2,3)8-5-4-7(10)6-11-8/h4-6H,1-3H3

Composition: C (50.49%), H (5.65%), Br (37.32%), N (6.54%)

Molar Mass: 214.106

Atom Count: 23

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	213.015312
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	HAJSOFXLKFWERP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.82
Topological Polar Surface Area	12.89
Polarizability	19.46
Ring Count	1
Rotatable Bond Count	1

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