AG00FBK1

7087-60-7 | 1-Fluoro-3-methoxy-5-nitrobenzene

AG00FBK1

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CAS Number	7087-60-7
Catalog Number	AG00FBK1(AGN-PC-0JO1IF)
Chemical Name	1-Fluoro-3-methoxy-5-nitrobenzene
IUPAC Name	1-fluoro-3-methoxy-5-nitrobenzene
InChI	InChI=1S/C7H6FNO3/c1-12-7-3-5(8)2-6(4-7)9(10)11/h2-4H,1H3
InChI Key	FPDLQPICBDMTLB-UHFFFAOYSA-N
MDL Number	MFCD11848484
Molecular Formula	C7H6FNO3
Molecular Weight	171.1258
NSC Number	109620
SMILES	COC1=CC(=CC(F)=C1)[N+]([O-])=O
Synonyms	1-fluoro-3-methoxy-5-nitrobenzene, 7087-60-7, 3-Fluoro-5-nitroanisole, 1-Fluoro-3-methoxy-5-nitro-benzene, 3-fluoro-5-nitro-anisole, NSC109620, ACMC-209oga, AC1L6LNF, AC1Q4NB6, SCHEMBL4824913, CTK5D3111, DTXSID70296493, FPDLQPICBDMTLB-UHFFFAOYSA-N, ZINC1701565, ANW-35960, MFCD11848484, AKOS015853011, NSC-109620, RP23331, AJ-30508, SC-36154, SY028335, TR-032888, V7416, MFCD11848484 (95%), B-4332, Z-8556, C7H6FNO3, AR-1C3105, CID269074, 7145-70-2,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.033g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	171.127g/mol
Monoisotopic Mass	171.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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

Lot Number