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Home > Encyclopedia > 2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid

2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid

2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid structure

2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid 

structure
  • CAS No:

    175203-21-1

  • Formula:

    C14H13NO4S2

  • Chemical Name:

    2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid

  • Synonyms:

    2-[2-(phenylsulfonyl)ethylthio]pyridine-3-carboxylic acid; 2-(2-(phenylsulfonyl)ethylthio)nicotinic acid; HMS555K06;

2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid Basic Attributes

323.38700

323.02860024

DTXSID90384881

2933399090

Characteristics

118.01000

3.42660

1.46g/cm3

580.5ºC at 760mmHg

304.9ºC

2.57E-14mmHg at 25°C

Safety Information

R36/37/38

S26; S36

Xi

Computed Properties

Molecular Weight:323.4
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:323.02860024
Monoisotopic Mass:323.02860024
Topological Polar Surface Area:118
Heavy Atom Count:21
Complexity:440
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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