AG003JFA

500912-14-1 | 1-(Bromomethyl)-3-fluoro-2-methylbenzene

AG003JFA

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CAS Number	500912-14-1
Catalog Number	AG003JFA(AGN-PC-0KKZFJ)
Chemical Name	1-(Bromomethyl)-3-fluoro-2-methylbenzene
IUPAC Name	1-(bromomethyl)-3-fluoro-2-methylbenzene
InChI	InChI=1S/C8H8BrF/c1-6-7(5-9)3-2-4-8(6)10/h2-4H,5H2,1H3
InChI Key	KIVGYOYBHWKBSZ-UHFFFAOYSA-N
MDL Number	MFCD03788543
Molecular Formula	C8H8BrF
Molecular Weight	203.0515
SMILES	CC1=C(CBr)C=CC=C1F
Synonyms	3-Fluoro-2-methylbenzyl bromide, 1-(bromomethyl)-3-fluoro-2-methylbenzene, 500912-14-1, MFCD03788543, AC1MCV3N, ACMC-20an44, SCHEMBL1144270, 3-Fluoro-2-methylbenzyl bromid, 3-fluoro-2-methyl-benzylbromide, CTK5I9854, DTXSID00381346, KIVGYOYBHWKBSZ-UHFFFAOYSA-N, JRD-1884, ZINC2510747, SBB093058, AKOS015956661, PS-10043, SC-61342, 3-(bromomethyl)-1-fluoro-2-methylbenzene, TC-169627, Benzene, 1-(bromomethyl)-3-fluoro-2-methyl-, I14-108477, CID2779244, 1-(bromomethyl)-3-fluoro-2-methyl-benzene,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.979g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.054g/mol
Monoisotopic Mass	201.979g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318-H319
Packing Group	Ⅱ
Precautionary statements	P280-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P310
UN Code	UN 1760

Certificate of Analysis

Lot Number