tert-butyl N-[6-(bromomethyl)pyridin-2-yl]carbamate

tert-butyl N-[6-(bromomethyl)pyridin-2-yl]carbamate

CAS: 400781-16-0

Formula: C11H15BrN2O2

SMILES: CC(C)(C)OC(=O)NC1=NC(CBr)=CC=C1

IUPAC: tert-butyl N-[6-(bromomethyl)pyridin-2-yl]carbamate

InChI: InChI=1S/C11H15BrN2O2/c1-11(2,3)16-10(15)14-9-6-4-5-8(7-12)13-9/h4-6H,7H2,1-3H3,(H,13,14,15)

Composition: C (46.01%), H (5.27%), Br (27.83%), N (9.76%), O (11.14%)

Molar Mass: 287.157

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	286.031691
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZXRNZPGQEIKABL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.83
Topological Polar Surface Area	51.22
Polarizability	25.14
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	400781-16-0		$1,100.00-$2,020.00$1,100.00$1,220.00$2,020.00