AG00I559

27129-86-8 | Benzene, 1-(bromomethyl)-3,5-dimethyl-

AG00I559

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CAS Number	27129-86-8
Catalog Number	AG00I559(AGN-PC-0JMRXF)
Chemical Name	Benzene, 1-(bromomethyl)-3,5-dimethyl-
IUPAC Name	1-(bromomethyl)-3,5-dimethylbenzene
InChI	InChI=1S/C9H11Br/c1-7-3-8(2)5-9(4-7)6-10/h3-5H,6H2,1-2H3
InChI Key	QXDHXCVJGBTQMK-UHFFFAOYSA-N
MDL Number	MFCD00013539
Molecular Formula	C9H11Br
Molecular Weight	199.0876
SMILES	C1=C(C=C(C=C1CBr)C)C
Synonyms	27129-86-8, 3,5-Dimethylbenzyl bromide, 1-(Bromomethyl)-3,5-dimethylbenzene, 3,5-Dimethylbenzylbromide, alpha-Bromomesitylene, Benzene, 1-(bromomethyl)-3,5-dimethyl-, .alpha.-Bromomesitylene, QXDHXCVJGBTQMK-UHFFFAOYSA-N, MFCD00013539, 3,5-Dimethylbenzyl bromide, 98%, 5-(bromomethyl)-1,3-dimethylbenzene, a-Bromomesitylene, PubChem9979, AC1L3IUW, AC1Q2IJV, 3,5dimethylbenzyl bromide, 5-(Bromomethyl)-m-xylene, 3,5-dimethyl benzylbromide, 3,5-dimethylbenzyI bromide, AC1Q2I9Q, 3,5-dimethyl benzyl bromide, KSC201S0R, 3,5-DiMethyl-Benzyl Bromide, SCHEMBL502038, ACMC-209z32, Jsp005282, CTK1A1908, ZERENEX ZX-IP003690, DTXSID70181592, BCP21668, KS-00000D2S, ZINC2560386, 3,5-Dimethylbenzyl Bromide, Pract., ANW-49740, BBL103385, FC0728, SBB008310, STL557195, AKOS000121560, 1-(bromomethyl)-3,5-dimethyl-benzene, CS-W002092, FR-1207, MCULE-3244049802, RP25669, RTR-012230, VZ25843, AJ-40575, AK-68241, BC003491, BR-68241, CJ-09552, N741, SC-03037, SY012664, AB0016009, DB-047167, ST2415060, TR-012230, 4CH-013410, AM20060585, FT-0622119, ST50828063, EN300-16610, MFCD00013539 (98%), 3,5-Dimethylbenzyl bromide, >=97.0% (GC), A818923, I01-5992, J-511357, C9H11Br, 2,5-Dimethylbenzyl chloride, OTAVA-BB 1779394, LABOTEST-BB LTBB005135, 1-Chloromethyl-2,5-dimethylbenzene, CID141334, 2-(Chloromethyl)-1,4-dimethylbenzene, A5293, 3,5-Dimethylbenzyl bromide, 98% - 1G 1g, M-4640, 81228-09-3,

Complexity	90.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.004g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.091g/mol
Monoisotopic Mass	198.004g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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