CAS
94135-16-7 Purity
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94135-16-7 Purity
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3-[2-[2-(p-Chlorophenoxy)-2-methylpropionyloxy]ethoxycarbonyl]pyridinium hydrogen sulfate
CAS
94135-26-9
Catalog Number
ACM94135269
Category
Other Products
Molecular Weight
461.870700 [g/mol]
Molecular Formula
C18H20ClNO9S
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Specification
Synonyms
EINECS 302-895-6, 3-(2-(2-(p-Chlorophenoxy)-2-methylpropionyloxy)ethoxycarbonyl)pyridinium hydrogen sulphate, 94135-26-9
IUPAC Name
2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl pyridin-1-ium-3-carboxylate; hydrogen sulfate
Canonical SMILES
CC(C)(C(=O)OCCOC(=O)C1=C[NH+]=CC=C1)OC2=CC=C(C=C2)Cl.OS(=O)(=O)[O-]
InChI Key
IOOLKHGOVZRWRU-UHFFFAOYSA-N
Boiling Point
637.2ºC at 760mmHg
Flash Point
339.1ºC
EC Number
302-895-6
Exact Mass
461.05500
H-Bond Acceptor
9
H-Bond Donor
2
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