2-bromo-4-tert-butyl-1-iodobenzene

2-bromo-4-tert-butyl-1-iodobenzene

CAS: 860435-39-8

Formula: C10H12BrI

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

IUPAC: 2-bromo-4-tert-butyl-1-iodobenzene

InChI: InChI=1S/C10H12BrI/c1-10(2,3)7-4-5-9(12)8(11)6-7/h4-6H,1-3H3

Composition: C (35.43%), H (3.57%), Br (23.57%), I (37.43%)

Molar Mass: 339.014

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	337.91671
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	XNKAPUCNAVBLOL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	65.71
Topological Polar Surface Area	0
Polarizability	25.63
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	860435-39-8		$41.61-$580.06$41.61$102.14$334.17$580.06