AG007BP5

111010-08-3 | Benzene, 1-bromo-2-chloro-4-fluoro-5-nitro-

AG007BP5

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CAS Number	111010-08-3
Catalog Number	AG007BP5(AGN-PC-0000T2)
Chemical Name	Benzene, 1-bromo-2-chloro-4-fluoro-5-nitro-
IUPAC Name	1-bromo-2-chloro-4-fluoro-5-nitrobenzene
InChI	InChI=1S/C6H2BrClFNO2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H
InChI Key	YVDJBLFLBBBGMD-UHFFFAOYSA-N
MDL Number	MFCD20528320
Molecular Formula	C6H2BrClFNO2
Molecular Weight	254.4410
SMILES	[O-][N+](=O)c1cc(Br)c(cc1F)Cl
Synonyms	1-Bromo-2-chloro-4-fluoro-5-nitrobenzene, 111010-08-3, Benzene, 1-bromo-2-chloro-4-fluoro-5-nitro-, ACMC-20mdwc, SCHEMBL7872533, CTK0D4339, DTXSID60553789, YVDJBLFLBBBGMD-UHFFFAOYSA-N, MFCD20528320, ZINC34201893, 5-bromo-4-chloro-2-fluoronitrobenzene, AS-48879, SC-11320, CS-0088553, Benzene,1-bromo-2-chloro-4-fluoro-5-nitro-,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	252.894g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	254.439g/mol
Monoisotopic Mass	252.894g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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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