AG006ZGJ

1375068-74-8 | 5-BroMo-2-fluoro-3-nitrotoluene

AG006ZGJ

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CAS Number	1375068-74-8
Catalog Number	AG006ZGJ(AGN-PC-0WALAD)
Chemical Name	5-BroMo-2-fluoro-3-nitrotoluene
IUPAC Name	5-bromo-2-fluoro-1-methyl-3-nitrobenzene
InChI	InChI=1S/C7H5BrFNO2/c1-4-2-5(8)3-6(7(4)9)10(11)12/h2-3H,1H3
InChI Key	DYNFTQDGEFBCPS-UHFFFAOYSA-N
MDL Number	MFCD22205727
Molecular Formula	C7H5BrFNO2
Molecular Weight	234.0225
SMILES	O=[N+](C1=C(F)C(C)=CC(Br)=C1)[O-]
Synonyms	5-Bromo-2-fluoro-3-nitrotoluene, 1375068-74-8, 5-bromo-2-fluoro-1-methyl-3-nitrobenzene, ACMC-209ccv, SCHEMBL18131689, CTK8B0639, DTXSID40742972, ANW-20285, MFCD22205727, ZINC85477206, AKOS024438522, AS-36917, TC-109030, V2731, B-9146, C7H5BrFNO2,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.949g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.024g/mol
Monoisotopic Mass	232.949g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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