Spermine dihydrate

C₁₀H₃₀N₄O₂CAS 403982-64-9238.38 g/mol

Open in Covalent MOL file

Primary amine Secondary amine

Properties

Molecular formula: C₁₀H₃₀N₄O₂
Molar mass: 238.38 g/mol
Exact mass: 238.2369 Da
logP: -2.01Crippen estimate
Polar surface area: 139.1 Å²
H-bond donors / acceptors: 4 / 4
Rotatable bonds: 11

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

403982-64-9

SMILES

C(CCNCCCN)CNCCCN.O.O

InChIKey

MTNRSMVAYLLBAV-UHFFFAOYSA-N

InChI

InChI=1S/C10H26N4.2H2O/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;;/h13-14H,1-12H2;2*1H2

Weigh it out

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

Work with Spermine dihydrate

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.

Spermine71-44-3Anhydrous Spermine tetrahydrochloride306-67-2Salt

Similar compounds

Spermidine124-20-988 % similar Bis(hexamethylene)triamine143-23-778 % similar Norspermidine56-18-876 % similar Spermidine trihydrochloride334-50-975 % similar N,N′-Bis(3-aminopropyl)ethylenediamine10563-26-572 % similar Norspermine4605-14-572 % similar 3-(Aminopropyl)ethylenediamine13531-52-768 % similar N-Dodecyl-1,3-propanediamine5538-95-458 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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