5-(4-Fluorophenyl)valeric acid - CAS 24484-22-8

Catalog:	BB018498
Product Name:	5-(4-Fluorophenyl)valeric acid
CAS:	24484-22-8
Synonyms:	5-(4-fluorophenyl)pentanoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-(4-fluorophenyl)pentanoic acid
Description:	5-(4-Fluorophenyl)valeric acid (CAS# 24484-22-8) is a useful research chemical.
Molecular Weight:	196.22
Molecular Formula:	C11H13FO2
Canonical SMILES:	C1=CC(=CC=C1CCCCC(=O)O)F
InChI:	InChI=1S/C11H13FO2/c12-10-7-5-9(6-8-10)3-1-2-4-11(13)14/h5-8H,1-4H2,(H,13,14)
InChI Key:	BXEFPLJKYWEEAN-UHFFFAOYSA-N
Boiling Point:	335.6 °C at 760 mmHg
Melting Point:	75-77 °C
Purity:	95 %
Density:	1.15 g/cm³
Appearance:	White to light yellow crystalline powder
MDL:	MFCD00800242
LogP:	2.62310

Publication Number	Title	Priority Date
KR-20180090852-A	Improved Apelin receptor (APJ) agonists and uses thereof	20151209
CN-104395324-A	Imidazo-oxadiazole and imidazo-thiadiazole derivatives	20120605
EP-2875006-A1	Acid ceramidase inhibitors and their use as medicaments	20120528
EP-2875006-B1	Acid ceramidase inhibitors and their use as medicaments	20120528
JP-2015518019-A	Acid ceramidase inhibitors and their use as pharmaceuticals	20120528

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
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[1383427-98-2]
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[1006443-01-1]
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[956439-56-8]
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[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[927800-47-3]
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[5310-68-9]
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Other Pyrimidines

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[452-76-6]
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[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[927800-47-3]
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[551-62-2]
1,2,3,4-Tetrafluorobenzene

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	174
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	196.08995782
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	196.08995782
Rotatable Bond Count:	5
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8