2-Fluorophenethylamine - CAS 52721-69-4

Name: 2-Fluorophenethylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB027918
Product Name:	2-Fluorophenethylamine
CAS:	52721-69-4
Synonyms:	2-(2-fluorophenyl)ethanamine

Technical Data

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Computed Properties

IUPAC Name:	2-(2-fluorophenyl)ethanamine
Description:	2-Fluorophenethylamine (CAS# 52721-69-4) is a useful research chemical.
Molecular Weight:	139.17
Molecular Formula:	C8H10FN
Canonical SMILES:	C1=CC=C(C(=C1)CCN)F
InChI:	InChI=1S/C8H10FN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5-6,10H2
InChI Key:	RIKUOLJPJNVTEP-UHFFFAOYSA-N
Boiling Point:	242.8 °C at 760 mmHg
Purity:	98 %
Density:	1.069 g/cm³
Appearance:	Clear pale yellow to slightly pink liquid
MDL:	MFCD00075502
LogP:	2.02720

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Related Functional Groups

Fluorinated Building Blocks

[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1011396-69-2]C12H17F2NO2
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Nitrogen Compounds

[32894-07-8]C9H11NS · HCl
Benzyl thioacetimidate hydrochloride
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[62838-59-9]C8H12N2
1-Cyclopentyl-1H-pyrazole
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile

Other Pyrimidines

[13566-71-7]C10H8N2O2
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[1632145-37-9]0
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione
[207605-39-8]C8H2F5NO2
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[551-62-2]C6H2F4
1,2,3,4-Tetrafluorobenzene
[860790-29-0]C11H15F3N4
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
[113583-35-0]C7H10N2O4S
4,6-Dimethoxy-2-(methylsulfonyl)pyrimidine

GHS Hazard Statement:	H315 (93.02%): 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

Publication Number	Title	Priority Date
CN-112480062-A	5-lipoxygenase activating protein activity inhibitor and preparation method thereof	20201214
CN-112079732-A	Synthetic route of 4-alkyl secondary amino-2-butanol compound	20200922
CN-112079732-B	Synthetic route of 4-alkyl secondary amino-2-butanol compound	20200922
WO-2021190169-A1	Light-emitting thin film and manufacturing method therefor, and electroluminescent device	20200323
WO-2021154704-A2	Methods and systems for reducing the concentration of amine in wash liquid used in industrial processing	20200129

PMID	Publication Date	Title	Journal
22890891	20121022	Effects of fluorine substitution on the shape of neurotransmitters: the rotational spectrum of 2-(2-fluorophenyl)ethanamine	Chemphyschem : a European journal of chemical physics and physical chemistry
18602830	20080801	Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1	Bioorganic & medicinal chemistry

Complexity:	95.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	139.079727485
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	139.079727485
Rotatable Bond Count:	2
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3