AG00EIF5

59021-15-7 | 3-Iodo-2,5-Dimethylpyrazine

AG00EIF5

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CAS Number	59021-15-7
Catalog Number	AG00EIF5(AGN-PC-0NKV9T)
Chemical Name	3-Iodo-2,5-Dimethylpyrazine
IUPAC Name	3-iodo-2,5-dimethylpyrazine
InChI	InChI=1S/C6H7IN2/c1-4-3-8-5(2)6(7)9-4/h3H,1-2H3
InChI Key	STLFJVQEKULVQV-UHFFFAOYSA-N
MDL Number	MFCD20484141
Molecular Formula	C6H7IN2
Molecular Weight	234.0377
SMILES	CC1=NC(I)=C(C)N=C1
Synonyms	3-Iodo-2,5-dimethylpyrazine, 59021-15-7, SCHEMBL2409427, CTK1E8333, DTXSID70577956, Pyrazine, 3-iodo-2,5-dimethyl-, KS-00000QI8, 8775AB, ANW-68137, MFCD20484141, ZINC34742045, AKOS016007200, AC-27088, AJ-90029, AK-80700, DA-17104, DS-16023, TC-156882, FT-0757087, C6H7IN2,

Complexity	97.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.965g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.04g/mol
Monoisotopic Mass	233.965g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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