AG005SHG

74866-17-4 | 1-BROMO-3,4-DIMETHOXY-2-METHYLBENZENE

AG005SHG

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CAS Number	74866-17-4
Catalog Number	AG005SHG(AGN-PC-0WAMM4)
Chemical Name	1-BROMO-3,4-DIMETHOXY-2-METHYLBENZENE
IUPAC Name	1-bromo-3,4-dimethoxy-2-methylbenzene
InChI	InChI=1S/C9H11BrO2/c1-6-7(10)4-5-8(11-2)9(6)12-3/h4-5H,1-3H3
InChI Key	JDIYVHQIOHSCQG-UHFFFAOYSA-N
MDL Number	MFCD01463690
Molecular Formula	C9H11BrO2
Molecular Weight	231.0864
SMILES	COC1=CC=C(Br)C(C)=C1OC
Synonyms	1-bromo-3,4-dimethoxy-2-methylbenzene, 74866-17-4, AK-87993, AE-562/12222516, AC1LGRY0, SCHEMBL2431072, 6-bromo-2,3-dimethoxy toluene, CTK5E0594, DTXSID90356548, JDIYVHQIOHSCQG-UHFFFAOYSA-N, ZINC345719, BCP21771, CS-M3412, 1639AC, ANW-63185, MFCD01463690, SBB097708, AKOS016004415, FCH1332714, 1,2-Dimethoxy-3-methyl-4-bromobenzene, KS-00000M73, AJ-20030, DS-18412, SC-31051, Benzene,1-bromo-3,4-dimethoxy-2-methyl-, AX8057388, DB-074893, TX-015913, FT-0752278, ST24037862, C9H11BrO2, CID825971, ZINC00345719, ACN-001209, Benzene, 1-bromo-3,4-dimethoxy-2-methyl-,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.994g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	231.089g/mol
Monoisotopic Mass	229.994g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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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