AG001CZU

140914-89-2 | 2-(Pyrazin-2-yl)acetic acid

AG001CZU

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CAS Number	140914-89-2
Catalog Number	AG001CZU(AGN-PC-02K88I)
Chemical Name	2-(Pyrazin-2-yl)acetic acid
IUPAC Name	2-pyrazin-2-ylacetic acid
InChI	InChI=1S/C6H6N2O2/c9-6(10)3-5-4-7-1-2-8-5/h1-2,4H,3H2,(H,9,10)
InChI Key	PSDADIDIQCPEQC-UHFFFAOYSA-N
MDL Number	MFCD06796638
Molecular Formula	C6H6N2O2
Molecular Weight	138.1240
SMILES	O=C(O)CC1=NC=CN=C1
Synonyms	140914-89-2, 2-Pyrazineacetic acid, 2-Pyrazine acetic acid, 2-(pyrazin-2-yl)acetic acid, 2-Pyrazineaceticacid, (Pyrazin-2-yl)acetic acid, Pyrazineacetic acid, pyrazin-2-yl-acetic acid, Pyrazine-2-aceticacid, 2-pyrazin-2-ylacetic Acid, 2-pyrazinylacetic acid, pyrazine-3-acetic acid, ACMC-20a2xk, pyrazin-2-ylacetic acid, SCHEMBL874457, CTK0G9781, DTXSID70600031, PSDADIDIQCPEQC-UHFFFAOYSA-N, 2-pyrazine acetic acid, AldrichCPR, ACT05161, KS-000024NZ, ANW-54726, CP-931, MFCD06796638, ZINC12650881, AKOS013154333, CS-W005774, DS-2158, PB10382, QC-6874, RP20428, VP40106, AJ-63008, AK-29844, SC-25279, AB0068977, ST2417173, TC-061192, 4CH-013790, A3042, FT-0648382, Z4152, Q-2320, Q-102266, C6H6N2O2,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.043g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	138.126g/mol
Monoisotopic Mass	138.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	\N

Certificate of Analysis

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