3-Fluoro-4-nitrobenzaldehyde - CAS 160538-51-2

Catalog:	BB011641
Product Name:	3-Fluoro-4-nitrobenzaldehyde
CAS:	160538-51-2
Synonyms:	3-fluoro-4-nitrobenzaldehyde; 3-fluoro-4-nitrobenzaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-fluoro-4-nitrobenzaldehyde
Description:	3-Fluoro-4-nitrobenzaldehyde (CAS# 160538-51-2) is a useful research chemical.
Molecular Weight:	169.11
Molecular Formula:	C7H4FNO3
Canonical SMILES:	C1=CC(=C(C=C1C=O)F)[N+](=O)[O-]
InChI:	InChI=1S/C7H4FNO3/c8-6-3-5(4-10)1-2-7(6)9(11)12/h1-4H
InChI Key:	BWUIGISQVCIQBT-UHFFFAOYSA-N
Boiling Point:	312 °C at 760 mmHg
Density:	1.443 g/cm³
MDL:	MFCD00968940
LogP:	2.06960

Publication Number	Title	Priority Date
CN-112266328-A	Synthetic route and preparation method of 3-fluoro-4-nitrobenzaldehyde	20201209
CN-111848599-A	Oxygen-containing five-membered heterocyclic compound, synthesis method, pharmaceutical composition and application	20200428
WO-2021203016-A2	Protein-protein interaction stabilizers	20200403
WO-2021188948-A1	Mdm2 degraders and uses thereof	20200319
WO-2021170109-A1	Tropomyosin receptor kinase (trk) degradation compounds and methods of use	20200226

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.01752115
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	169.01752115
Rotatable Bond Count:	1
Topological Polar Surface Area:	62.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4