Benzathine
Properties
- Molecular formula
- C16H20N2
- Molar mass
- 240.35 g/mol
- Exact mass
- 240.1626 Da
- Density
- 1.024 g/mL (at 20 °C)
- Melting point
- 26 °C
- Boiling point
- 212–213 °C
- logP
- 2.57Crippen estimate
- Polar surface area
- 24.1 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 7
Identifiers
CAS number
140-28-3SMILES
c1ccc(CNCCNCc2ccccc2)cc1InChIKey
JUHORIMYRDESRB-UHFFFAOYSA-NInChI
InChI=1S/C16H20N2/c1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
15 names · show all
- 1,2-Ethanediamine, N1,N2-bis(phenylmethyl)-
- Ethylenediamine, N,N′-dibenzyl-
- 1,2-Ethanediamine, N,N′-bis(phenylmethyl)-
- N1,N2-Bis(phenylmethyl)-1,2-ethanediamine
- Benzatin
- 1,2-Bis(benzylamino)ethane
- DBED
- N,N′-Dibenzylethylenediamine
- N,N′-Dibenzyl-1,2-ethanediamine
- N,N′-Dibenzyl-1,2-ethylenediamine
- N,N′-Dibenzyl-1,2-diaminoethane
- N,N′-Bis(phenylmethyl)-1,2-ethanediamine
- NSC 5632
- NSC 62936
- Benzyl (2-(benzylamino)ethyl)amine
Work with Benzathine
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern