AG000KRR

1235492-43-9 | 1,2-Difluoro-3-methoxy-5-nitrobenzene

AG000KRR

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CAS Number	1235492-43-9
Catalog Number	AG000KRR(AGN-PC-0WCZ1D)
Chemical Name	1,2-Difluoro-3-methoxy-5-nitrobenzene
IUPAC Name	1,2-difluoro-3-methoxy-5-nitrobenzene
InChI	InChI=1S/C7H5F2NO3/c1-13-6-3-4(10(11)12)2-5(8)7(6)9/h2-3H,1H3
InChI Key	VLYKDOPLRIZFCY-UHFFFAOYSA-N
MDL Number	MFCD28348447
Molecular Formula	C7H5F2NO3
Molecular Weight	189.1163
SMILES	COC1=CC([N+]([O-])=O)=CC(F)=C1F
Synonyms	1,2-difluoro-3-methoxy-5-nitrobenzene, 1235492-43-9, SCHEMBL962535, VLYKDOPLRIZFCY-UHFFFAOYSA-N, ZINC114927900, FCH4124840, PC430272, AX8276869, Benzene, 1,2-difluoro-3-methoxy-5-nitro-,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.024g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	189.118g/mol
Monoisotopic Mass	189.024g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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