AG003KX4

67868-73-9 | 4-Bromo-2-methoxy-1-methylbenzene

AG003KX4

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CAS Number	67868-73-9
Catalog Number	AG003KX4(AGN-PC-0022SL)
Chemical Name	4-Bromo-2-methoxy-1-methylbenzene
IUPAC Name	4-bromo-2-methoxy-1-methylbenzene
InChI	InChI=1S/C8H9BrO/c1-6-3-4-7(9)5-8(6)10-2/h3-5H,1-2H3
InChI Key	RAQYGVDRDNKTOM-UHFFFAOYSA-N
MDL Number	MFCD06797972
Molecular Formula	C8H9BrO
Molecular Weight	201.0605
SMILES	c1(c(ccc(c1)Br)C)OC
Synonyms	4-Bromo-2-methoxy-1-methylbenzene, 67868-73-9, 4-BROMO-2-METHOXYTOLUENE, 5-BROMO-2-METHYLANISOLE, Benzene, 4-bromo-2-methoxy-1-methyl-, 2-methyl-5-bromoanisole, MFCD06797972, KSC292Q2R, SCHEMBL5156534, CTK1J2828, DTXSID60562518, RAQYGVDRDNKTOM-UHFFFAOYSA-N, ACT12849, KS-00000P2L, 5-bromo-2-methylphenol methyl ether, 4-bromo-2-methoxy-1-methyl-benzene, ANW-48487, ZINC28278329, AKOS015919637, AM61644, AS03406, CS-W008193, MB04159, TRA-0184254, AJ-83409, AK-65070, AS-18499, BC005108, BR-65070, CJ-17667, SY041361, AB0026209, DB-073937, RT-004028, FT-0761520, ST24023351, W7820, MFCD06797972 (97%), Q-8023, 5-bromo-2-methylphenol, C8H9BrO, ?4-Bromo-2-methoxy-1-methylbenzene,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.984g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	201.063g/mol
Monoisotopic Mass	199.984g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

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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