methyl 6-[(1S)-1-aminoethyl]pyridine-3-carboxylate dihydrochloride

methyl 6-[(1S)-1-aminoethyl]pyridine-3-carboxylate dihydrochloride

CAS: 2566172-09-4

Formula: C9H14Cl2N2O2

SMILES: Cl.Cl.COC(=O)C1=CC=C(N=C1)[C@H](C)N

IUPAC: methyl 6-[(1S)-1-aminoethyl]pyridine-3-carboxylate dihydrochloride

InChI: InChI=1S/C9H12N2O2.2ClH/c1-6(10)8-4-3-7(5-11-8)9(12)13-2;;/h3-6H,10H2,1-2H3;2*1H/t6-;;/m0../s1

Composition: C (42.71%), H (5.58%), Cl (28.01%), N (11.07%), O (12.64%)

Molar Mass: 253.12

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	252.0432331
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XZIUFUIZHCTTLA-ILKKLZGPSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.37
Topological Polar Surface Area	65.21
Polarizability	19.06
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	2566172-09-4		$524.58-$809.56$524.58$809.56