AG003E49

7087-65-2 | 1-Bromo-3-fluoro-5-nitrobenzene

AG003E49

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CAS Number	7087-65-2
Catalog Number	AG003E49(AGN-PC-003DER)
Chemical Name	1-Bromo-3-fluoro-5-nitrobenzene
IUPAC Name	1-bromo-3-fluoro-5-nitrobenzene
InChI	InChI=1S/C6H3BrFNO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H
InChI Key	SWXVEPMSQBEVRH-UHFFFAOYSA-N
MDL Number	MFCD09955454
Molecular Formula	C6H3BrFNO2
Molecular Weight	219.9959
SMILES	N(=O)(=O)c1cc(Br)cc(c1)F
Synonyms	1-bromo-3-fluoro-5-nitrobenzene, 7087-65-2, 1-nitro-3-Fluoro-5-bromobenzene, 3-BROMO-5-FLUORONITROBENZENE, MFCD09955454, Benzene, 1-bromo-3-fluoro-5-nitro-, PubChem17569, ACMC-209ogb, SCHEMBL2649497, CTK8B2207, DTXSID20567064, SWXVEPMSQBEVRH-UHFFFAOYSA-N, KS-00000KW3, 3-FLUORO-5-NITROBROMOBENZENE, ANW-35961, CL8235, ZINC21981692, AKOS015919948, CS-W007693, GS-4040, RP05134, TRA0065125, 5-BROMO-3-FLUORO-1-NITROBENZENE, AJ-78892, AK-37426, BC004267, BC226734, BC652336, BR-37426, CJ-16992, SC-89615, AB0007292, ST2415235, TC-010816, TC-124706, 4CH-000854, AM20041055, FT-0650927, S-2848, I01-6195, J-504424, 3-bromo-5-fluoroaniline, RW1396,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.933g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	219.997g/mol
Monoisotopic Mass	218.933g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

Lot Number