AG001PEB

157335-97-2 | Pyrimidine, 5-bromo-4,6-dimethyl-

AG001PEB

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CAS Number	157335-97-2
Catalog Number	AG001PEB(AGN-PC-0030HI)
Chemical Name	Pyrimidine, 5-bromo-4,6-dimethyl-
IUPAC Name	5-bromo-4,6-dimethylpyrimidine
InChI	InChI=1S/C6H7BrN2/c1-4-6(7)5(2)9-3-8-4/h3H,1-2H3
InChI Key	WDMWXYZJJVYMHE-UHFFFAOYSA-N
MDL Number	MFCD08059561
Molecular Formula	C6H7BrN2
Molecular Weight	187.0372
SMILES	CC1=C(Br)C(C)=NC=N1
Synonyms	5-Bromo-4,6-dimethylpyrimidine, 157335-97-2, Pyrimidine, 5-bromo-4,6-dimethyl-, AK-24845, SCHEMBL2327689, CTK6C4490, 5-bromo-4,6-dimethyl-pyrimidine, DTXSID80565465, WDMWXYZJJVYMHE-UHFFFAOYSA-N, ZX-AT016416, FCH922871, MFCD08059561, OR5845, SBB054507, STL279995, ZINC16124086, AKOS006345043, FS-2672, MCULE-2591020369, PB26303, RP24709, 4,6-DIMETHYL-5-BROMOPYRIMIDINE, AJ-68273, SC-68840, DB-064171, ST1141050, CS-0045927, FT-0716355, KS-00000724, B90005, Q-1084, J-517066,

Complexity	87.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.979g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	187.04g/mol
Monoisotopic Mass	185.979g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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