AG00EH8D

58139-04-1 | 2-Iodo-3-methoxypyrazine

AG00EH8D

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CAS Number	58139-04-1
Catalog Number	AG00EH8D(AGN-PC-0NDTNJ)
Chemical Name	2-Iodo-3-methoxypyrazine
IUPAC Name	2-iodo-3-methoxypyrazine
InChI	InChI=1S/C5H5IN2O/c1-9-5-4(6)7-2-3-8-5/h2-3H,1H3
InChI Key	PDMRYBKGSOJHJJ-UHFFFAOYSA-N
MDL Number	MFCD09955597
Molecular Formula	C5H5IN2O
Molecular Weight	236.0105
SMILES	COC1=NC=CN=C1I
Synonyms	2-Iodo-3-methoxypyrazine, 58139-04-1, ACMC-209m2u, Pyrazine, 2-iodo-3-methoxy-, SCHEMBL1899290, CTK7B2174, DTXSID20450523, PDMRYBKGSOJHJJ-UHFFFAOYSA-N, KS-00000Q1O, ANW-32884, MFCD09955597, ZINC15444671, 2-Iodo-3-methoxypyrazine, AldrichCPR, AKOS015851827, GS-6127, RP08448, AC-23252, AJ-67574, AK-94547, DB-072431, TR-038971, FT-0685435, ST24022271, V6756, J-509705, 2-iodo-3-methoxy-pyrazine, C5H5IN2O, CID10977417,

Complexity	91
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.945g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	236.012g/mol
Monoisotopic Mass	235.945g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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