AG00C6K3

38789-75-2 | 5-METHOXYPYRAZINECARBOXYLIC ACID METHYL ESTER

AG00C6K3

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CAS Number	38789-75-2
Catalog Number	AG00C6K3(AGN-PC-0JRJSB)
Chemical Name	5-METHOXYPYRAZINECARBOXYLIC ACID METHYL ESTER
IUPAC Name	methyl 5-methoxypyrazine-2-carboxylate
InChI	InChI=1S/C7H8N2O3/c1-11-6-4-8-5(3-9-6)7(10)12-2/h3-4H,1-2H3
InChI Key	AZXXFTKAVQJXCU-UHFFFAOYSA-N
MDL Number	MFCD00736231
Molecular Formula	C7H8N2O3
Molecular Weight	168.1500
SMILES	O=C(C1=NC=C(OC)N=C1)OC
Synonyms	Methyl 5-methoxypyrazine-2-carboxylate, 38789-75-2, Methyl 5-Methoxypyrazinecarboxylate, 5-methoxypyrazinecarboxylic acid methyl ester, AC1LAB14, CHEMBL334283, SCHEMBL13524601, CTK8I5426, DTXSID10332768, AZXXFTKAVQJXCU-UHFFFAOYSA-N, CS-M3285, ZINC6485140, MFCD18417636, QC-583, RB3230, AKOS016011964, MCULE-5673941157, NE42940, AJ-56240, NS-01359, AB0088150, DB-069724, 4CH-022207, FT-0645406, ST24048011, Z3257, 5-methoxy-2-Pyrazinecarboxylic acid methyl ester, 5-Methoxy-pyrazine-2-carboxylic acid methyl ester, Z1436472850, Pyrazinoic acid esters der., C7H8N2O3, AIDS043764, CID465070, Methyl5-methoxypyrazine-2-carboxylate,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.152g/mol
Monoisotopic Mass	168.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	61.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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