Homocaldopentamine structure

Homocaldopentamine

N'-[3-[3-(3-aminopropylamino)propylamino]propyl]butane-1,4-diamine

Also Known As: Homocaldopentamine|1,6-Diamino-4,8,12-triazahexadecane|1,16-diamino-4,8,12-triazahexadecane|N'-[3-[3-(3-aminopropylamino)propylamino]propyl]butane-1,4-diamine|1,4-Butanediamine, N-(3-((3-((3-aminopropyl)amino)propyl)amino)propyl)-|N'-(3-(3-(3-aminopropylamino)propylamino)propyl)butane-1,4-diamine|N-[3-[3-(3-aminopropylamino)propylamino]propyl]butane-1,4-diamine|N-[3-[[3-[(3-Aminopropyl)amino]propyl]amino]propyl]-1,4-butanediamine|N~1~-[3-({3-[(3-Aminopropyl)amino]propyl}amino)propyl]butane-1,4-diamine|(12S)-5,6,8,9,11,12,14,15-octadeuterio-12-hydroxyicosa-5,8,10,14-tetraenoic acid|(4-AMINOBUTYL)[3-({3-[(3-AMINOPROPYL)AMINO]PROPYL}AMINO)PROPYL]AMINE

CAS: 84807-90-9
Molecular Formula C13H33N5
Molecular Weight 259.2736 g/mol
LogP -1.2
Topological Polar Surface Area 88.1 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 5
Rotatable Bonds 15
Exact Mass 259.2736
Monoisotopic Mass 259.2736
Heavy Atoms 18
Complexity 143.0

Chemical Identifiers

CAS Number 84807-90-9
SMILES C(CCNCCCNCCCNCCCN)CN
InChIKey FPTWYQKWFMIJPT-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Catalysts (1 patents) Organometallic Reagents (1 patents)

Product Overview

Homocaldopentamine (CAS 84807-90-9), with molecular formula C13H33N5 and molecular weight 259.2736 g/mol. IUPAC: N'-[3-[3-(3-aminopropylamino)propylamino]propyl]butane-1,4-diamine.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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