1-benzyl-4-bromopyridin-1-ium bromide

1-benzyl-4-bromopyridin-1-ium bromide

CAS: 2589-30-2

Formula: C12H11Br2N

SMILES: [Br-].BrC1=CC=[N+](CC2=CC=CC=C2)C=C1

IUPAC: 1-benzyl-4-bromopyridin-1-ium bromide

InChI: InChI=1S/C12H11BrN.BrH/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11;/h1-9H,10H2;1H/q+1;/p-1

Composition: C (43.80%), H (3.37%), Br (48.57%), N (4.26%)

Molar Mass: 329.035

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	326.925825
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	HIKUSYNCUQPEOO-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	62.29
Topological Polar Surface Area	3.88
Polarizability	23.71
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<8 Days	2589-30-2		$48.57-$699.43$48.57$145.71$233.14$437.14$699.43