3-Aminofluoranthene - CAS 2693-46-1

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

Catalog:	BB019411
Product Name:	3-Aminofluoranthene
CAS:	2693-46-1
Synonyms:	fluoranthen-3-amine

Technical Data

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Computed Properties

IUPAC Name:	fluoranthen-3-amine
Description:	Fluoranthen-3-amine has been studied as a possible fluorescent probes for ligand-binding assays of odorant-binding proteins.
Molecular Weight:	217.27
Molecular Formula:	C16H11N
Canonical SMILES:	C1=CC=C2C(=C1)C3=C4C2=CC=CC4=C(C=C3)N
InChI:	InChI=1S/C16H11N/c17-15-9-8-13-11-5-2-1-4-10(11)12-6-3-7-14(15)16(12)13/h1-9H,17H2
InChI Key:	VHGJAFIHUSTRGB-UHFFFAOYSA-N
Boiling Point:	440.8 °C at 760 mmHg
Melting Point:	115-117 °C
Purity:	95 %
Density:	1.322 g/cm³
Appearance:	Solid
MDL:	MFCD00001185
LogP:	4.65060

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[937273-31-9]C12H14ClNO4
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[618-40-6]C7H10N2
1-Methyl-1-phenylhydrazine
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile
[916792-07-9]C8H5BrFN
2-Bromo-4-fluoro-5-methylbenzonitrile
[514801-07-1]C13H12ClN3O4
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde

GHS Hazard Statement:	H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P273, P280, P301+P312, P305+P351+P338, P330, P337+P313, P391, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
KR-20210102066-A	Method of screening for reagents activating PPARÎ³ using reporter gene assay system	20200210
WO-2021033728-A1	Compound, material for organic electroluminescent elements, organic electroluminescent element, and electronic device	20190819
JP-2019049586-A	Light selective transmission filter	20170907
US-2020071277-A1	Photoreactive ligands and uses thereof	20170118
CN-107663169-A	A kind of 6H naphtho-s [2,1,8,7 klmn] acridine derivatives and its application	20160727

PMID	Publication Date	Title	Journal
22619628	20120101	The use of silver solid amalgam electrodes for voltammetric and amperometric determination of nitrated polyaromatic compounds used as markers of incomplete combustion	TheScientificWorldJournal
19879285	20100201	Differential effects of nitro-PAHs and amino-PAHs on cytokine and chemokine responses in human bronchial epithelial BEAS-2B cells	Toxicology and applied pharmacology
19041363	20090131	3-Nitrofluoranthene (3-NF) but not 3-aminofluoranthene (3-AF) elicits apoptosis as well as programmed necrosis in Hepa1c1c7 cells	Toxicology

Complexity:	300
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	217.089149355
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	217.089149355
Rotatable Bond Count:	0
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2