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2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID

2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID structure

CAS No:
3383-66-2
Formula:
C10H9NO2S2
Chemical Name:
2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID
Synonyms:
2-(benzothiazol-2-ylsulfanyl)propionic acid;2-(1,3-benzothiazol-2-ylsulfanyl)propanoic acid;2-(Benzothiazol-2-ylsulfanyl)-propionic acid;2-(benzo[d]thiazol-2-ylthio)propanoic acid;Propanoic acid,2-(2-benzothiazolylthio)-;2-(1,3-benzothiazol-2-ylthio)propanoic acid;2-benzothiazol-2-ylthiopropanoic acid;ChemDiv1_017957;SCHEMBL718296;CTK4H1297

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2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID Basic Attributes

Molecular Weight：

239.31

Exact Mass：

239.00700

DSSTox ID：

DTXSID00387681

Characteristics

PSA：

103.73000

XLogP3：

2.86150

Boiling Point：

413.4ºC at 760 mmHg

Flash Point：

203.8ºC

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

Marks：

Xi,T

Computed Properties

Molecular Weight:239.3
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:239.00747088
Monoisotopic Mass:239.00747088
Topological Polar Surface Area:104
Heavy Atom Count:15
Complexity:250
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-(BENZOTHIAZOL-2-YLSULFANYL)-PROPIONICACID

SDS

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