chempirical

1,6-Bis(cyanoguanidino)hexane

C10H18N8CAS 15894-70-9250.31 g/mol

Open in Covalent MOL file
NNHNHNHNHNHNHN
GuanidineNitrile

Properties

Molecular formula
C10H18N8
Molar mass
250.31 g/mol
Exact mass
250.1654 Da
Melting point
202–203 °C
logP
-0.26Crippen estimate
Polar surface area
143.4 Ų
H-bond donors / acceptors
6 / 4
Rotatable bonds
7

Identifiers

CAS number
15894-70-9
SMILES
N#CNC(=N)NCCCCCCNC(=N)NC#N
InChIKey
YXZZOMVBHPCKMM-UHFFFAOYSA-N
InChI
InChI=1S/C10H18N8/c11-7-17-9(13)15-5-3-1-2-4-6-16-10(14)18-8-12/h1-6H2,(H3,13,15,17)(H3,14,16,18)

Weigh it out

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

Names and synonyms

8 names
  • Guanidine, N,N′′′-1,6-hexanediylbis[N′-cyano-
  • Guanidine, 1,1′-hexamethylenebis[3-cyano-
  • N,N′′′-1,6-Hexanediylbis[N′-cyanoguanidine]
  • 1,6-Bis(N3-cyano-N1-guanidino)hexane
  • Hexamethylenebis(dicyanodiamide)
  • 1,6-Di(cyanoguanidino)hexane
  • N,N′-Bis(cyanoguanidine)-1,6-hexanediamine
  • 2-[6-[[Amino-(cyanoamino)methylidene]amino]hexyl]-1-cyanoguanidine

Work with 1,6-Bis(cyanoguanidino)hexane

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

Similar compounds

Guanidine, N,N′′′-1,6-hexanediylbis[N′-cyano-, polymer with 1,6-hexanediamine, hydrochloride27083-27-871 % similar 2-Cyanoguanidine461-58-543 % similar Iminoctadine13516-27-339 % similar Polyaminopropyl biguanide133029-32-037 % similar Chlorhexidine55-56-135 % similar N-Octadecylurea2158-08-934 % similar Dodecylguanidine hydrochloride13590-97-133 % similar Chlorhexidine hydrochloride3697-42-533 % similar

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

Elsewhere

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