5-(4-Fluorophenyl)-1H-imidazol-2-amine - CAS 60472-17-5

Catalog:	BB030696
Product Name:	5-(4-Fluorophenyl)-1H-imidazol-2-amine
CAS:	60472-17-5
Synonyms:	5-(4-fluorophenyl)-1H-imidazol-2-amine

Technical Data

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Computed Properties

IUPAC Name:	5-(4-fluorophenyl)-1H-imidazol-2-amine
Description:	5-(4-Fluorophenyl)-1H-imidazol-2-amine (CAS# 60472-17-5) is a useful research chemical.
Molecular Weight:	177.18
Molecular Formula:	C9H8FN3
Canonical SMILES:	C1=CC(=CC=C1C2=CN=C(N2)N)F
InChI:	InChI=1S/C9H8FN3/c10-7-3-1-6(2-4-7)8-5-12-9(11)13-8/h1-5H,(H3,11,12,13)
InChI Key:	ANHNVGOEKUWHGJ-UHFFFAOYSA-N
Boiling Point:	415 °C at 760 mmHg
Density:	1.334 g/cm³
MDL:	MFCD07382513
LogP:	2.37920

Publication Number	Title	Priority Date
US-2006089316-A1	Method for reducing a susceptibility to tumor formation induced by 3-deoxyglucosone and precursors thereof	20041025
EP-1716127-A2	Guanidine compounds, and use thereof as binding partners for 5-ht5 receptors	20040219
EP-1716127-B1	Guanidine compounds, and use thereof as binding partners for 5-ht5 receptors	20040219
EP-2366392-A1	Guanidine compounds and use of same as binding partners for 5-HT5 receptors	20040219
EP-2366697-A1	Guanidine compounds and use of same as binding partners for 5-HT5 receptors	20040219

PMID	Publication Date	Title	Journal
21550812	20110601	Structure-activity relationship of 2-hydroxy-2-aryl-2,3-dihydro-imidazo[1,2-a]pyrimidinium salts and 2N-substituted 4(5)-aryl-2-amino-1H-imidazoles as inhibitors of biofilm formation by Salmonella Typhimurium and Pseudomonas aeruginosa	Bioorganic & medicinal chemistry
21174477	20110127	Structure-activity relationship of 4(5)-aryl-2-amino-1H-imidazoles, N1-substituted 2-aminoimidazoles and imidazo[1,2-a]pyrimidinium salts as inhibitors of biofilm formation by Salmonella typhimurium and Pseudomonas aeruginosa	Journal of medicinal chemistry

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501
Signal Word:	Danger

Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.07022543
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	177.07022543
Rotatable Bond Count:	1
Topological Polar Surface Area:	54.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5