AG0096WG

1189434-55-6 | Ethyl 6-(aminomethyl)nicotinate, HCl

AG0096WG

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CAS Number	1189434-55-6
Catalog Number	AG0096WG(AGN-PC-0BSFT7)
Chemical Name	Ethyl 6-(aminomethyl)nicotinate, HCl
IUPAC Name	ethyl 6-(aminomethyl)pyridine-3-carboxylate;hydrochloride
InChI	InChI=1S/C9H12N2O2.ClH/c1-2-13-9(12)7-3-4-8(5-10)11-6-7;/h3-4,6H,2,5,10H2,1H3;1H
InChI Key	MJACJEKUVRQBHU-UHFFFAOYSA-N
MDL Number	MFCD09788628
Molecular Formula	C9H13ClN2O2
Molecular Weight	216.6647
SMILES	O=C(OCC)C1=CN=C(CN)C=C1.[H]Cl
Synonyms	ETHYL 6-(AMINOMETHYL)NICOTINATE HYDROCHLORIDE, 1189434-55-6, ETHYL 6-(AMINOMETHYL)NICOTINATE HCL, AK161056, SCHEMBL9901295, CTK6F6555, KS-00000SKN, MJACJEKUVRQBHU-UHFFFAOYSA-N, ZX-RL004035, AR2222, MFCD09788628, Ethyl 6-(aminomethyl)nicotinate, HCl, AKOS024463912, CHM0076466, DS-9847, OR301304, AX8294040, ST24047120, A-7371, ethyl 6-(aminomethyl)-3-pyridinecarboxylate HCl,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.067g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	216.665g/mol
Monoisotopic Mass	216.067g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	65.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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