AG004X95

83341-28-0 | 5-Fluoro-4-methyl-2-nitrophenol

AG004X95

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CAS Number	83341-28-0
Catalog Number	AG004X95(AGN-PC-0NK91C)
Chemical Name	5-Fluoro-4-methyl-2-nitrophenol
IUPAC Name	5-fluoro-4-methyl-2-nitrophenol
InChI	InChI=1S/C7H6FNO3/c1-4-2-6(9(11)12)7(10)3-5(4)8/h2-3,10H,1H3
InChI Key	SYRLVBSEEMWFMS-UHFFFAOYSA-N
MDL Number	MFCD16658619
Molecular Formula	C7H6FNO3
Molecular Weight	171.1258
SMILES	OC1=CC(F)=C(C)C=C1[N+]([O-])=O
Synonyms	5-FLUORO-4-METHYL-2-NITROPHENOL, 83341-28-0, SCHEMBL309964, CTK2I6269, DTXSID00509745, 2-Nitro-4-methyl-5-fluorophenol, 4-Methyl-5-fluoro-2-nitrophenol, SYRLVBSEEMWFMS-UHFFFAOYSA-N, 5-Fluoro-4-methyl-2-nitro-phenol, ZINC71257210, Phenol, 5-fluoro-4-methyl-2-nitro-, ACN-051018, AJ-117781, FT-0713776, V7904, C7H6FNO3,

Complexity	182
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	1
Isotope Atom Count	0
Molecular Weight	171.127g/mol
Monoisotopic Mass	171.033g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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