AG0010U1

132559-91-2 | 2H-Pyran-2-one, 4-bromo-6-methyl-

AG0010U1

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CAS Number	132559-91-2
Catalog Number	AG0010U1(AGN-PC-0061BH)
Chemical Name	2H-Pyran-2-one, 4-bromo-6-methyl-
IUPAC Name	4-bromo-6-methylpyran-2-one
InChI	InChI=1S/C6H5BrO2/c1-4-2-5(7)3-6(8)9-4/h2-3H,1H3
InChI Key	LLFSFJYWGVKYRP-UHFFFAOYSA-N
MDL Number	MFCD23136928
Molecular Formula	C6H5BrO2
Molecular Weight	189.0067
SMILES	Brc1cc(C)oc(=O)c1
Synonyms	4-bromo-6-methyl-2h-pyran-2-one, 132559-91-2, 2H-Pyran-2-one, 4-bromo-6-methyl-, 4-bromo-6-methyl-2-pyrone, ACMC-20muke, SCHEMBL1804389, CTK0F5021, DTXSID30461206, LLFSFJYWGVKYRP-UHFFFAOYSA-N, 4-bromo-6-methyl-2(2H)-pyranone, MFCD23136928, ZINC117165008, CS-0036276, 4-bromo-6-methyl-pyran-2-one, CID11286939,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.947g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	189.008g/mol
Monoisotopic Mass	187.947g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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