AG00H5EX

930798-25-7 | (6-Chloropyrazin-2-yl)acetic acid

AG00H5EX

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CAS Number	930798-25-7
Catalog Number	AG00H5EX(AGN-PC-00SCMV)
Chemical Name	(6-Chloropyrazin-2-yl)acetic acid
IUPAC Name	2-(6-chloropyrazin-2-yl)acetic acid
InChI	InChI=1S/C6H5ClN2O2/c7-5-3-8-2-4(9-5)1-6(10)11/h2-3H,1H2,(H,10,11)
InChI Key	GKCGKFUOTLQOGO-UHFFFAOYSA-N
MDL Number	MFCD09907855
Molecular Formula	C6H5ClN2O2
Molecular Weight	172.5691
SMILES	O=C(O)CC1=NC(Cl)=CN=C1
Synonyms	930798-25-7, 2-(6-chloropyrazin-2-yl)acetic acid, (6-CHLOROPYRAZIN-2-YL)ACETIC ACID, AK-26671, J-501667, 6-chloro-2-Pyrazineacetic acid, SCHEMBL5302445, CTK8B6066, KS-00000HMX, DTXSID30581695, GKCGKFUOTLQOGO-UHFFFAOYSA-N, (6-Chloropyrazine-2-yl)acetic acid, ANW-52389, FCH876151, MFCD09907855, ZINC34984419, AKOS006312733, QC-6792, RP23493, AJ-90566, BR-26671, SC-34406, AB0027718, AX8159701, DB-079479, TR-029173, 4CH-008422, FT-0650256, ST24027588, W9585, S-6140, aceticacid, C6H5ClN2O2, CS-4411,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.004g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.568g/mol
Monoisotopic Mass	172.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number