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methyl 6-amino-3-(4-tert-butylphenyl)pyridine-2-carboxylate

methyl 6-amino-3-(4-tert-butylphenyl)pyridine-2-carboxylate

CAS: 1280786-65-3

Formula: C17H20N2O2

SMILES: COC(=O)C1=NC(N)=CC=C1C1=CC=C(C=C1)C(C)(C)C

IUPAC: methyl 6-amino-3-(4-tert-butylphenyl)pyridine-2-carboxylate

InChI: InChI=1S/C17H20N2O2/c1-17(2,3)12-7-5-11(6-8-12)13-9-10-14(18)19-15(13)16(20)21-4/h5-10H,1-4H3,(H2,18,19)

Composition: C (71.81%), H (7.09%), N (9.85%), O (11.25%)

Molar Mass: 284.359

Atom Count: 41

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 284.152477892
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey DXBKSVVZXZVJGD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.37
Topological Polar Surface Area 65.21
Polarizability 33.25
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 1280786-65-3 $626.75-$1,713.50$626.75$1,713.50
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