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4-amino-6-chloro-2-methylpyridine-3-carboxylic acid

4-amino-6-chloro-2-methylpyridine-3-carboxylic acid

CAS: 2386388-03-8

Formula: C7H7ClN2O2

SMILES: CC1=NC(Cl)=CC(N)=C1C(O)=O

IUPAC: 4-amino-6-chloro-2-methylpyridine-3-carboxylic acid

InChI: InChI=1S/C7H7ClN2O2/c1-3-6(7(11)12)4(9)2-5(8)10-3/h2H,1H3,(H2,9,10)(H,11,12)

Composition: C (45.06%), H (3.78%), Cl (19.00%), N (15.01%), O (17.15%)

Molar Mass: 186.6

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.0196052
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey RRJHJERXTCJAGB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.32
Topological Polar Surface Area 76.21
Polarizability 16.72
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 2386388-03-8 $74.40-$547.27$74.40$118.53$199.24$547.27
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