AG001LDM

Name: 3-(Ethoxycarbonyl)pyridin-1-ium-1-olate
Brand: Angene Chemical
SKU: AG001LDM

14906-63-9 | 3-(Ethoxycarbonyl)pyridin-1-ium-1-olate

AG001LDM

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CAS Number	14906-63-9
Catalog Number	AG001LDM(AGN-PC-0JNRCH)
Chemical Name	3-(Ethoxycarbonyl)pyridin-1-ium-1-olate
IUPAC Name	ethyl 1-oxidopyridin-1-ium-3-carboxylate
InChI	InChI=1S/C8H9NO3/c1-2-12-8(10)7-4-3-5-9(11)6-7/h3-6H,2H2,1H3
InChI Key	HPFQJBOXPBNOJK-UHFFFAOYSA-N
MDL Number	MFCD16547429
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	CCOC(C1=C[N+]([O-])=CC=C1)=O
Synonyms	MLS002693958, 3-(ethoxycarbonyl)pyridin-1-ium-1-olate, 14906-63-9, NSC75655, ethyl pyridine-3-carboxylate 1-oxide, AC1L5NI6, NCIOpen2_000699, AC1Q221Y, SCHEMBL4862698, 3-ethoxycarbonylpyridine N-oxide, CHEMBL1876932, CTK4C6030, DTXSID20291453, HPFQJBOXPBNOJK-UHFFFAOYSA-N, HMS3079L19, 3-(Ethoxycarbonyl)pyridine 1-oxide, ZINC1701719, NSC-75655, NSC207859, NE43245, NSC-207859, ethyl 1-oxidopyridin-1-ium-3-carboxylate, SMR001559895, 3-Pyridinecarboxylicacid, ethyl ester, 1-oxide, 3-Pyridinecarboxylic acid, ethyl ester, 1-oxide, AR-1J0032, CID253138, 17832-28-9,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.058g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	167.164g/mol
Monoisotopic Mass	167.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited