5-bromo-2-tert-butylpyrimidine

5-bromo-2-tert-butylpyrimidine

CAS: 85929-94-8

Formula: C8H11BrN2

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

IUPAC: 5-bromo-2-tert-butylpyrimidine

InChI: InChI=1S/C8H11BrN2/c1-8(2,3)7-10-4-6(9)5-11-7/h4-5H,1-3H3

Composition: C (44.67%), H (5.15%), Br (37.15%), N (13.02%)

Molar Mass: 215.094

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.010561
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FAAQGONYZKWBKC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.67
Topological Polar Surface Area	25.78
Polarizability	18.65
Ring Count	1
Rotatable Bond Count	1

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