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tert-butyl N-(5-bromo-4-methylpyridin-2-yl)carbamate

tert-butyl N-(5-bromo-4-methylpyridin-2-yl)carbamate

CAS: 748812-64-8

Formula: C11H15BrN2O2

SMILES: CC1=CC(NC(=O)OC(C)(C)C)=NC=C1Br

IUPAC: tert-butyl N-(5-bromo-4-methylpyridin-2-yl)carbamate

InChI: InChI=1S/C11H15BrN2O2/c1-7-5-9(13-6-8(7)12)14-10(15)16-11(2,3)4/h5-6H,1-4H3,(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 UCZJLIDBVAZFBF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.17
Topological Polar Surface Area 51.22
Polarizability 25.17
Ring Count 1
Rotatable Bond Count 3

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