AG003FI1

52197-12-3 | 2,3-DICYANO-5-METHYLPYRAZINE

AG003FI1

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CAS Number	52197-12-3
Catalog Number	AG003FI1(AGN-PC-0JOLW1)
Chemical Name	2,3-DICYANO-5-METHYLPYRAZINE
IUPAC Name	5-methylpyrazine-2,3-dicarbonitrile
InChI	InChI=1S/C7H4N4/c1-5-4-10-6(2-8)7(3-9)11-5/h4H,1H3
InChI Key	RHYUBLSWHDYKAO-UHFFFAOYSA-N
MDL Number	MFCD00191635
Molecular Formula	C7H4N4
Molecular Weight	144.1335
NSC Number	175273
SMILES	N#CC1=NC=C(C)N=C1C#N
Synonyms	2,3-Dicyano-5-methylpyrazine, 5-methylpyrazine-2,3-dicarbonitrile, 52197-12-3, 5-methyl-2,3-pyrazinedicarbonitrile, AQ-917/42754173, NSC175273, AC1Q2OFS, AC1L6WH3, ACMC-1B03N, SCHEMBL1617515, CTK1H5215, KS-00000MKO, DTXSID70306304, ZINC337842, 4860AE, ANW-31423, FCH917780, MFCD00191635, SBB055882, AKOS006228986, MCULE-3322197716, NSC-175273, ACM52197123, AK167453, DA-42210, TS-01878, ZB010885, TR-018540, D2281, FT-0768111, I14-56482, C7H4N4, CID300516, 83410-18-8,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.044g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	144.137g/mol
Monoisotopic Mass	144.044g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	73.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3439

Certificate of Analysis

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