3-Fluoro-5-nitroanisole - CAS 7087-60-7

Name: 3-Fluoro-5-nitroanisole
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB034257
Product Name:	3-Fluoro-5-nitroanisole
CAS:	7087-60-7
Synonyms:	1-fluoro-3-methoxy-5-nitrobenzene; 1-fluoro-3-methoxy-5-nitrobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-fluoro-3-methoxy-5-nitrobenzene
Description:	3-Fluoro-5-nitroanisole (CAS# 7087-60-7) is a useful research chemical.
Molecular Weight:	171.13
Molecular Formula:	C7H6FNO3
Canonical SMILES:	COC1=CC(=CC(=C1)[N+](=O)[O-])F
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
Boiling Point:	244.5 °C at 760 mmHg
Density:	1.321 g/cm³
Appearance:	Powder
LogP:	2.26570

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Related Functional Groups

Nitrogen Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[937273-31-9]C12H14ClNO4
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1243387-55-4]C10H8F3NO3
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H302 (100%): 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

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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:	1.8