3-(4-((E)-2-[4-(DIDECYLAMINO)PHENYL]ETHENYL)-1-PYRIDINIUMYL)-1-PROPANESULFONATE

CAS No.
70807-63-5
CCD No.
CCD00136199
Formula
C36 H58 N2 O3 S
MolWeight
598.931

Basic Information

Product Name: 3-(4-((E)-2-[4-(DIDECYLAMINO)PHENYL]ETHENYL)-1-PYRIDINIUMYL)-1-PROPANESULFONATE
CAS: 70807-63-5
English Synonyms: 3-(4-((E)-2-[4-(DIDECYLAMINO)PHENYL]ETHENYL)-1-PYRIDINIUMYL)-1-PROPANESULFONATE
MDL Number.: MFCD00467813
H bond acceptor: 5
H bond donor: 0
Smile: CCCCCCCCCCN(CCCCCCCCCC)c1ccc(cc1)/C=C/c2cc[n+](cc2)CCCS(=O)(=O)[O-]
InChi: InChI=1S/C36H58N2O3S/c1-3-5-7-9-11-13-15-17-29-38(30-18-16-14-12-10-8-6-4-2)36-24-22-34(23-25-36)20-21-35-26-31-37(32-27-35)28-19-33-42(39,40)41/h20-27,31-32H,3-19,28-30,33H2,1-2H3
InChiKey: InChIKey=TUVYBNWSFFLWHI-UHFFFAOYSA-N

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