4-Pentyn-1-amine - CAS 15252-44-5

Catalog:	BB010791
Product Name:	4-Pentyn-1-amine
CAS:	15252-44-5
Synonyms:	pent-4-yn-1-amine

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Computed Properties

IUPAC Name:	pent-4-yn-1-amine
Description:	4-Pentyn-1-amine (CAS# 15252-44-5) is a useful research chemical.
Molecular Weight:	83.13
Molecular Formula:	C5H9N
Canonical SMILES:	C#CCCCN
InChI:	InChI=1S/C5H9N/c1-2-3-4-5-6/h1H,3-6H2
InChI Key:	LMDDPGHBJXJGAC-UHFFFAOYSA-N
Appearance:	Colorless to yellowish liquid
LogP:	1.05880

Publication Number	Title	Priority Date
CN-113248473-A	Preparation and medical application of targeted GSK3 alpha/beta degradation agent	20210526
CN-111920959-A	ROS (reactive oxygen species) -responsive heparin polysaccharide nano prodrug compound based on click reaction, nano preparation, and preparation method and application thereof	20200724
WO-2021130329-A1	Radiolabeled peptides for non-invasive diagnosis and treatment of cxcr4 expressing tumors	20191227
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021112933-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204

PMID	Publication Date	Title	Journal
19381423	20090514	Rhodium(I) and iridium(I) complexes containing bidentate phosphine-imidazolyl donor ligands as catalysts for the hydroamination and hydrothiolation of alkynes	Dalton transactions (Cambridge, England : 2003)
19378556	20090128	Weakly coordinating counter-ions for highly efficient catalysis of intramolecular hydroamination	Dalton transactions (Cambridge, England : 2003)
14698161	20040119	Synthesis and biological characterisation of [3H]BBL454, a new CCK2 selective radiolabelled agonist displaying original pharmacological properties	Bioorganic & medicinal chemistry letters
11257536	20010413	Fluorescent DNA: the development of 7-deazapurine nucleoside triphosphates applicable for sequencing at the single molecule level	Journal of biotechnology

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GHS Hazard Statement:	H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	57.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	83.073499291
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	83.073499291
Rotatable Bond Count:	2
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2