57155-63-2

Name (-)-N-DODECYL-N-METHYLEPHEDRINIUM BROMIDE
CAS 57155-63-2
EINECS(EC#) 260-596-5
Molecular Formula C23H42BrNO
MDL Number MFCD00011907
Molecular Weight 428.49
MOL File 57155-63-2.mol

Chemical Properties

Melting point  80-82 °C(lit.)
form  powder
Optical Rotation [α]20/D 12.5°, c = 1 in chloroform
BRN  5421952
InChI 1S/C23H42NO.BrH/c1-5-6-7-8-9-10-11-12-13-17-20-24(3,4)21(2)23(25)22-18-15-14-16-19-22;/h14-16,18-19,21,23,25H,5-13,17,20H2,1-4H3;1H/q+1;/p-1/t21-,23-;/m0./s1
InChIKey GOIUTZPQFMGLAH-IUQUCOCYSA-M
SMILES [Br-].CCCCCCCCCCCC[N+](C)(C)[C@@H](C)[C@H](O)c1ccccc1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319-H335-H315
Precautionary statements  P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids

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