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2-(3-methylpyridin-1-ium-1-yl)ethanesulfonate

2-(3-methylpyridin-1-ium-1-yl)ethanesulfonate structure

CAS No:
58928-09-9
Formula:
C8H11NO3S
Chemical Name:
2-(3-methylpyridin-1-ium-1-yl)ethanesulfonate
Synonyms:
STK833473;AKOS000596506;MCULE-4058092367;2-(3-methylpyridinium-1-yl)ethanesulfonate;58928-09-9

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2-(3-methylpyridin-1-ium-1-yl)ethanesulfonate Basic Attributes

Molecular Weight：

201.25 g/mol

Exact Mass：

201.04596439 g/mol

Characteristics

PSA：

69.5 Å²

XLogP3：

0.9085

Melting Point：

279 - 280 °C (aq. ethanol)

Computed Properties

Molecular Weight:201.25
XLogP3:0.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:201.04596439
Monoisotopic Mass:201.04596439
Topological Polar Surface Area:69.5
Heavy Atom Count:13
Complexity:231
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3-methylpyridin-1-ium-1-yl)ethanesulfonate

Basic Attributes
Characteristics
Computed Properties

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