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tert-butyl 4-amino-5-bromopyridine-2-carboxylate

tert-butyl 4-amino-5-bromopyridine-2-carboxylate

CAS: 868171-70-4

Formula: C10H13BrN2O2

SMILES: CC(C)(C)OC(=O)C1=NC=C(Br)C(N)=C1

IUPAC: tert-butyl 4-amino-5-bromopyridine-2-carboxylate

InChI: InChI=1S/C10H13BrN2O2/c1-10(2,3)15-9(14)8-4-7(12)6(11)5-13-8/h4-5H,1-3H3,(H2,12,13)

Composition: C (43.98%), H (4.80%), Br (29.25%), N (10.26%), O (11.72%)

Molar Mass: 273.13

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 272.016041
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HBOVPYWDRQPVII-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.68
Topological Polar Surface Area 65.21
Polarizability 23.42
Ring Count 1
Rotatable Bond Count 3

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