tert-butyl N-(5-bromopyridin-2-yl)-N-methylcarbamate

tert-butyl N-(5-bromopyridin-2-yl)-N-methylcarbamate

CAS: 227939-01-7

Formula: C11H15BrN2O2

SMILES: CN(C(=O)OC(C)(C)C)C1=CC=C(Br)C=N1

IUPAC: tert-butyl N-(5-bromopyridin-2-yl)-N-methylcarbamate

InChI: InChI=1S/C11H15BrN2O2/c1-11(2,3)16-10(15)14(4)9-6-5-8(12)7-13-9/h5-7H,1-4H3

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	0
InChIKey	YHTZSPWLJTZRDM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.25
Topological Polar Surface Area	42.43
Polarizability	25.24
Ring Count	1
Rotatable Bond Count	3

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