AG001QYC

1588441-30-8 | Phenol, 4-fluoro-2-methyl-6-nitro-

AG001QYC

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CAS Number	1588441-30-8
Catalog Number	AG001QYC(AGN-PC-0WAN9Y)
Chemical Name	Phenol, 4-fluoro-2-methyl-6-nitro-
IUPAC Name	4-fluoro-2-methyl-6-nitrophenol
InChI	InChI=1S/C7H6FNO3/c1-4-2-5(8)3-6(7(4)10)9(11)12/h2-3,10H,1H3
InChI Key	YSSPDRCAPPNOIU-UHFFFAOYSA-N
MDL Number	MFCD27923653
Molecular Formula	C7H6FNO3
Molecular Weight	171.1258
SMILES	OC1=C([N+]([O-])=O)C=C(F)C=C1C
Synonyms	4-Fluoro-2-methyl-6-nitrophenol, 1588441-30-8, AK145601, SCHEMBL17744391, MFCD27923653, ZINC95670858, AKOS022178039, Phenol, 4-fluoro-2-methyl-6-nitro-, ACN-048616, DS-3092, FCH2496796, 5-Fluoro-3-methyl-2-hydroxy-nitrobenzene, PC500330, AJ-133500, ST2411411,

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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