Basic information
- CAS
41640-76-0- Standard SMILES
c1ccc(CNCCCCCNCc2ccccc2)cc1- InChIKey
IMWDTSQNQPMQDP-UHFFFAOYSA-N- Molecular formula
- C19H26N2
- Average molar mass
- 282.4 g/mol
- Monoisotopic mass
- 282.20959884
Overview
inhibits cross linkage of fibrin
Names & identifiers
- Preferred name
- Dibenzylcadaverine
- IUPAC
- N,N'-dibenzylpentane-1,5-diamine
- English name
- dibenzylcadaverine
- Molecular formula
- C19H26N2
- Molecular weight
- 282.42
Names & synonyms
Dibenzylcadaverine41640-76-0RefChem:1328701,5-Pentanediamine, N,N'-bis(phenylmethyl)-N,N'-dibenzylpentane-1,5-diamineNCIOpen2_008200SCHEMBL7202099CHEMBL3086935DTXSID10961870N~1~,N~5~-Dibenzylpentane-1,5-diamine1,5-Pentanediamine, N1,N5-bis(phenylmethyl)-
Database identifiers
- CAS
41640-76-0- PubChem CID
- 414973
- DTXSID
DTXSID10961870- ChEMBL
CHEMBL3086935- Nikkaji
- J2.207.926C
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Boiling point
- 415.083 · 415.083±33.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.998 · 0.998±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.033 · 10.033±0.19(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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