391901-45-4

Name BenzeneMethanol, a-[[[2-(4-aMinophenyl)ethyl]aMino]Methyl]-, (aR)-
CAS 391901-45-4
Molecular Formula C16H20N2O
MDL Number MFCD28125625
Molecular Weight 256.34
MOL File 391901-45-4.mol

Chemical Properties

Melting point  97-100°C
Boiling point  447.9±24.0 °C(Predicted)
density  1.137±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  Chloroform (Slightly), DMSO (Sparingly), Methanol (Slightly)
form  Solid
pka 13.98±0.20(Predicted)
color  Off-White to Light Beige
Major Application pharmaceutical
InChI InChI=1/C16H20N2O/c17-15-8-6-13(7-9-15)10-11-18-12-16(19)14-4-2-1-3-5-14/h1-9,16,18-19H,10-12,17H2/t16-/s3
InChIKey TUAHDMSPHZSMQN-QEIABERDNA-N
SMILES [C@@H](O)(C1=CC=CC=C1)CNCCC1=CC=C(N)C=C1 |&1:0,r|

Safety Data

Symbol(GHS)  Health Hazard (GHS08)Environment (GHS09)Skull and Crossbones (GHS06)
GHS08,GHS09,GHS06
Signal word  Danger
Hazard statements  H301-H361-H317-H373-H411
Precautionary statements  P264-P270-P301+P310-P321-P330-P405-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P201-P202-P281-P308+P313-P405-P501-P260-P314-P501
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier