98835-90-6

Name Octyl 5-N,N-diethylamino-2-phenylsulfonyl-2,4-pentadienoate
CAS 98835-90-6
Molecular Formula C23H35NO4S
Molecular Weight 421.59
MOL File 98835-90-6.mol
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Chemical Properties

Boiling point  555.382±50.00 °C(Press: 760.00 Torr)(predicted)
density  1.072
pka 6.533±0.70(predicted)
InChI InChI=1S/C23H35NO4S/c1-4-7-8-9-10-14-20-28-23(25)22(18-15-19-24(5-2)6-3)29(26,27)21-16-12-11-13-17-21/h11-13,15-19H,4-10,14,20H2,1-3H3
InChIKey LBNUXTQQOXBRAR-UHFFFAOYSA-N
SMILES C(OCCCCCCCC)(=O)C(S(C1=CC=CC=C1)(=O)=O)=CC=CN(CC)CC

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338

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