CAS 27268-50-4 – Benzothiazolium, 5-chloro-2-[2-[[5-chloro-3… | DempoChem

Chemical structure of CAS 27268-50-4

Benzothiazolium, 5-chloro-2-[2-[[5-chloro-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd with N,N-diethylethanamine (1:1)

CAS No.	27268-50-4
MDL No.	N/A
MF	C₃₁H₄₁Cl₂N₃O₆S₄
MW	750.80
InChI Key	ONJDQJZWBDZPHG-UHFFFAOYSA-N

CUSTOM SYNTHESIS

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Product Information

CAS No.	27268-50-4
Product Name	Benzothiazolium, 5-chloro-2-[2-[[5-chloro-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd with N,N-diethylethanamine (1:1)

Heavy Atom Count	46	Rotatable Bond Count	14
Atom Stereo Count	0	Bond Stereo Count	2
HBA	9	HBD	1
TPSA	121.930 Å²	Charge	0
Exact Mass	749.12553	Complexity	1766.26
pKa	11.873	XLogP	7.304