Spermidine trihydrochloride

C7H22Cl3N3CAS 334-50-9254.62 g/mol

Open in Covalent MOL file
HClHClHClH2NNHNH2
Primary amineSecondary amine

Properties

Molecular formula
C7H22Cl3N3
Molar mass
254.62 g/mol
Exact mass
253.0879 Da
Melting point
256–258 °C
logP
0.93Crippen estimate
Polar surface area
64.1 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
7

Hazards

Warning
Irritant (GHS07)

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
334-50-9
SMILES
Cl.Cl.Cl.NCCCCNCCCN
InChIKey
LCNBIHVSOPXFMR-UHFFFAOYSA-N
InChI
InChI=1S/C7H19N3.3ClH/c8-4-1-2-6-10-7-3-5-9;;;/h10H,1-9H2;3*1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • 1,4-Butanediamine, N1-(3-aminopropyl)-, hydrochloride (1:3)
  • 1,4-Butanediamine, N-(3-aminopropyl)-, trihydrochloride
  • Spermidine hydrochloride

Work with Spermidine trihydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Spermidine124-20-9Free base Spermidine phosphate49721-50-8Salt

Similar compounds

Spermine tetrahydrochloride306-67-294 % similar Spermine71-44-378 % similar Spermine dihydrate403982-64-975 % similar Bis(hexamethylene)triamine143-23-774 % similar Norspermidine56-18-872 % similar N,N′-Bis(3-aminopropyl)ethylenediamine10563-26-568 % similar Norspermine4605-14-568 % similar 3-(Aminopropyl)ethylenediamine13531-52-765 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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