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methyl 2-amino-2-(pyridin-2-yl)acetate dihydrochloride

methyl 2-amino-2-(pyridin-2-yl)acetate dihydrochloride

CAS: 1039356-77-8

Formula: C8H12Cl2N2O2

SMILES: Cl.Cl.COC(=O)C(N)C1=CC=CC=N1

IUPAC: methyl 2-amino-2-(pyridin-2-yl)acetate dihydrochloride

InChI: InChI=1/C8H10N2O2.2ClH/c1-12-8(11)7(9)6-4-2-3-5-10-6;;/h2-5,7H,9H2,1H3;2*1H

Composition: C (40.19%), H (5.06%), Cl (29.65%), N (11.72%), O (13.38%)

Molar Mass: 239.1

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 238.027583
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey YEDLXAKJINMFAC-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.6
Topological Polar Surface Area 65.21
Polarizability 17.25
Ring Count 1
Rotatable Bond Count 3

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