AG007LHV

1352317-80-6 | 1-Bromo-2-fluoro-4-methoxy-3-nitrobenzene

AG007LHV

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CAS Number	1352317-80-6
Catalog Number	AG007LHV(AGN-PC-0BGI58)
Chemical Name	1-Bromo-2-fluoro-4-methoxy-3-nitrobenzene
IUPAC Name	1-bromo-2-fluoro-4-methoxy-3-nitrobenzene
InChI	InChI=1S/C7H5BrFNO3/c1-13-5-3-2-4(8)6(9)7(5)10(11)12/h2-3H,1H3
InChI Key	LJJAOMRFFXQENV-UHFFFAOYSA-N
MDL Number	MFCD20491421
Molecular Formula	C7H5BrFNO3
Molecular Weight	250.0219
SMILES	O=[N+](C1=C(F)C(Br)=CC=C1OC)[O-]
Synonyms	andecaliximab, GS-5745, GS5745, 1-bromo-2-fluoro-4-methoxy-3-nitrobenzene, 1352317-80-6, 4-Bromo-3-fluoro-2-nitroanisole, ACMC-209bya, SCHEMBL16738853, CTK8B0280, DTXSID90718324, LJJAOMRFFXQENV-UHFFFAOYSA-N, ANW-19760, MFCD20491421, ZINC74937735, AKOS024262586, FCH1417640, GS-5745, KS-0000265A, SY122371, AJ-121431, AX8292363, TC-108505, Z9847, MFCD20491421 (95%), B-9272, C7H5BrFNO3,

Complexity	199
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.944g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.023g/mol
Monoisotopic Mass	248.944g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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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