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3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID

3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID structure

CAS No:
883-50-1
Formula:
C10H9NO3S
Chemical Name:
3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID
Synonyms:
3(2H)-benzothiazolepropanoic acid, 2-oxo-;3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONIC ACID;3-(2-oxo-1,3-benzothiazol-3-yl)propanoic acid;3-(2-keto-1,3-benzothiazol-3-yl)propionic acid;3-(2-OXO-1,3-BENZOTHIAZOL-3(2H)-YL)PROPANOIC ACID
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID Basic Attributes

Molecular Weight：

223.24800

Exact Mass：

223.03000

DSSTox ID：

DTXSID50349537

HScode：

2934200090

Characteristics

PSA：

87.54000

XLogP3：

1.53770

Density：

1.447g/cm3

Melting Point：

102-104ºC

Boiling Point：

452.9ºC at 760 mmHg

Flash Point：

227.7ºC

Refractive Index：

1.654

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Xi: Irritant;

Computed Properties

Molecular Weight:223.25
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:223.03031432
Monoisotopic Mass:223.03031432
Topological Polar Surface Area:82.9
Heavy Atom Count:15
Complexity:282
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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3-(2-OXO-BENZOTHIAZOL-3-YL)-PROPIONICACID

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