AG00376W

58534-94-4 | 3-Bromo-2-fluoronitrobenzene

AG00376W

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CAS Number	58534-94-4
Catalog Number	AG00376W(AGN-PC-05W5IF)
Chemical Name	3-Bromo-2-fluoronitrobenzene
IUPAC Name	1-bromo-2-fluoro-3-nitrobenzene
InChI	InChI=1S/C6H3BrFNO2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H
InChI Key	MWYFDHRLYOKUMH-UHFFFAOYSA-N
MDL Number	MFCD05663754
Molecular Formula	C6H3BrFNO2
Molecular Weight	219.9959
SMILES	BrC=1C(=C(C=CC1)[N+](=O)[O-])F
Synonyms	3-Bromo-2-fluoronitrobenzene, 58534-94-4, 1-bromo-2-fluoro-3-nitrobenzene, 1-bromo-2-fluoro-3-nitro-benzene, 1-Bromo-3-nitro-2-fluoro-benzene, 3-bromo-2-fluoro-1-nitrobenzene, BENZENE, 1-BROMO-2-FLUORO-3-NITRO-, MFCD05663754, PubChem4298, bromofluoronitro-benzene, SCHEMBL6349, KSC494C0H, 3-bromo-2-fluoro-nitrobenzene, ACMC-209m55, CTK3J4103, DTXSID10654275, MWYFDHRLYOKUMH-UHFFFAOYSA-N, WT285, ACT12590, BCP24601, KS-000005JZ, ZINC2547857, ANW-32967, BBL103641, Benzene,1-bromo-2-fluoro-3-nitro-, CL8950, SBB064464, STL557451, AKOS005064067, AC-1749, AS01520, CM12093, CS-W004659, LF10564, LS10297, QC-7600, RP27221, RTX-011877, VZ21238, AJ-39422, AK-35754, AN-14614, AS-18427, BC002751, BC675869, BR-35754, CJ-09292, EN002095, SC-05532, SY024387, AB0025663, DB-072494, ST2415213, 4CH-002449, 58534-94-4 3-bromo-2-fluoronitrobenzene, AM20061030, FT-0647723, W7160, MFCD05663754 (97%), A20466, C-6088, 534B944, I01-4901, J-511863, 1-Bromo-2-fluoro-3-nitrobenzene;2-Fluoro-3-bromonitrobenzene, C6H3BrFNO2, ACN-046802, C2072,

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	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number