5-Fluoro-2-nitroanisole - CAS 448-19-1

Catalog:	BB025709
Product Name:	5-Fluoro-2-nitroanisole
CAS:	448-19-1
Synonyms:	4-fluoro-2-methoxy-1-nitrobenzene; 4-fluoro-2-methoxy-1-nitrobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-fluoro-2-methoxy-1-nitrobenzene
Description:	5-Fluoro-2-nitroanisole (CAS# 448-19-1) is a reagent used in the synthetic preparation of imidazopyridines as inhibitors of insulin-like growth factor-1 receptor.
Molecular Weight:	171.13
Molecular Formula:	C7H6FNO3
Canonical SMILES:	COC1=C(C=CC(=C1)F)[N+](=O)[O-]
InChI:	InChI=1S/C7H6FNO3/c1-12-7-4-5(8)2-3-6(7)9(10)11/h2-4H,1H3
InChI Key:	WLKUSVNHZXUEFO-UHFFFAOYSA-N
Boiling Point:	245.8 °C at 760 mmHg
Density:	1.321 g/cm³
MDL:	MFCD00077541
LogP:	2.26570

Publication Number	Title	Priority Date
CN-112409192-A	Purification method of 4-fluoro-2-methoxyaniline	20201126
CN-112341406-A	Synthesis method of trans-4- [4- (3-methoxy-4-nitrophenyl) -1-piperazinyl ] adamantane-1-ol	20201118
WO-2021193543-A1	Compound, composition, cured product, and method for producing cured product	20200324
CN-111285851-A	Compound for targeted degradation of focal adhesion kinase and application thereof in medicine	20200323
WO-2021190413-A1	Compound for targeted degradation of focal adhesion kinase and medical application thereof	20200323

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Related Functional Groups

Nitrogen Compounds

[937273-31-9]
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[62838-59-9]
1-Cyclopentyl-1H-pyrazole
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2

GHS Hazard Statement:	H302 (85.11%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.03317122
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.03317122
Rotatable Bond Count:	1
Topological Polar Surface Area:	55 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7