ISONICOTINIC ACID, 1,2,5,6-TETRAHYDRO-1-METHYL-, METHYL ESTER, HYDROCHLORIDE

methyl 1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-carboxylate chloride

CAS: 52632-29-8

Molecular Formula	`C8H14ClNO2`
Molecular Weight	191.65 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	191.0713
Heavy Atoms	12
Complexity	187.0

Chemical Identifiers

CAS Number	52632-29-8
SMILES	`C[NH+]1CCC(=CC1)C(=O)OC.[Cl-]`
InChIKey	`ACZLGIGMHGHJGH-UHFFFAOYSA-N`

📖 Product Overview

ISONICOTINIC ACID, 1,2,5,6-TETRAHYDRO-1-METHYL-, METHYL ESTER, HYDROCHLORIDE (CAS: 52632-29-8) is a chemical compound with molecular formula C8H14ClNO2 and molecular weight 191.65 g/mol. Its IUPAC systematic name is methyl 1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-carboxylate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 191.0713 Heavy Atoms 12 Complexity 187.0 InChI Key: ACZLGIGMHGHJGH-UHFFFAOYSA-N. SMILES: C[NH+]1CCC(=CC1)C(=O)OC.[Cl-].

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