AG0068S3

69696-37-3 | 5-Bromo-2,4-dimethylpyrimidine

AG0068S3

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CAS Number	69696-37-3
Catalog Number	AG0068S3(AGN-PC-0NJ5I9)
Chemical Name	5-Bromo-2,4-dimethylpyrimidine
IUPAC Name	5-bromo-2,4-dimethylpyrimidine
InChI	InChI=1S/C6H7BrN2/c1-4-6(7)3-8-5(2)9-4/h3H,1-2H3
InChI Key	UITPCPFEEVHRRJ-UHFFFAOYSA-N
MDL Number	MFCD13705449
Molecular Formula	C6H7BrN2
Molecular Weight	187.0372
SMILES	CC1=NC(C)=C(Br)C=N1
Synonyms	5-Bromo-2,4-dimethylpyrimidine, 69696-37-3, Pyrimidine, 5-bromo-2,4-dimethyl-, 5-bromo-2,4-dimethyl-pyrimidine, SCHEMBL7251854, 5-Bromo-2,6-dimethylpyrimidine, CTK1H5343, DTXSID40500216, UITPCPFEEVHRRJ-UHFFFAOYSA-N, KS-00000QV5, ANW-70000, MFCD13705449, ZINC39236613, AKOS015946803, AB70482, CS-W019070, DS-3599, AJ-99283, AK100705, SY032161, ST2411761, TC-158745, 4CH-016754, X6083, MFCD13705449 (95%), C6H7BrN2, 60186-89-2,

Complexity	97.1
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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