AG008C4H

875238-74-7 | 3-BROMO-4-TRIFLUOROMETHYLNITROBENZENE

AG008C4H

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CAS Number	875238-74-7
Catalog Number	AG008C4H(AGN-PC-0WAMRL)
Chemical Name	3-BROMO-4-TRIFLUOROMETHYLNITROBENZENE
IUPAC Name	2-bromo-4-nitro-1-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF3NO2/c8-6-3-4(12(13)14)1-2-5(6)7(9,10)11/h1-3H
InChI Key	WPUMBZRKLJGMIJ-UHFFFAOYSA-N
MDL Number	MFCD16606317
Molecular Formula	C7H3BrF3NO2
Molecular Weight	270.0034
SMILES	FC(C1=CC=C([N+]([O-])=O)C=C1Br)(F)F
Synonyms	2-Bromo-4-nitro-1-(trifluoromethyl)benzene, 875238-74-7, 2-Bromo-4-nitrobenzotrifluoride, 3-BROMO-4-TRIFLUOROMETHYLNITROBENZENE, SCHEMBL15123102, CTK8B9026, DTXSID20735180, WPUMBZRKLJGMIJ-UHFFFAOYSA-N, 3872AC, ANW-61855, CL8899, MFCD16606317, ZINC85220953, AKOS015995520, AK-53630, DS-14260, AJ-126831, TC-150600, CS-0041268, X-3402, C7H3BrF3NO2,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.93g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	270.005g/mol
Monoisotopic Mass	268.93g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number