AG001TDB

162744-47-0 | 1-Bromo-2-fluoro-4-(methoxymethyl)benzene

AG001TDB

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CAS Number	162744-47-0
Catalog Number	AG001TDB(AGN-PC-0WD0P2)
Chemical Name	1-Bromo-2-fluoro-4-(methoxymethyl)benzene
IUPAC Name	1-bromo-2-fluoro-4-(methoxymethyl)benzene
InChI	InChI=1S/C8H8BrFO/c1-11-5-6-2-3-7(9)8(10)4-6/h2-4H,5H2,1H3
InChI Key	FCRIACNFIULRHL-UHFFFAOYSA-N
MDL Number	MFCD13250192
Molecular Formula	C8H8BrFO
Molecular Weight	219.0509
SMILES	COCC1=CC(F)=C(Br)C=C1
Synonyms	1-BROMO-2-FLUORO-4-(METHOXYMETHYL)BENZENE, 162744-47-0, Benzene, 1-bromo-2-fluoro-4-(methoxymethyl)-, Intermediates-ZCF02224, SCHEMBL1367932, CTK4D1330, DTXSID90608978, FCRIACNFIULRHL-UHFFFAOYSA-N, ANW-54811, CK1208, MFCD13250192, ZINC44830808, AKOS015995442, AS05948, CM13295, AS-45840, SC-49868, AB0034064, AJ-110150, DB-023335, TX-015910, FT-0709417, X8156, X-1347, C8H8BrFO,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.974g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	219.053g/mol
Monoisotopic Mass	217.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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