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5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI)

5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI) structure

CAS No:
103264-09-1
Formula:
C10H9NO2S
Chemical Name:
5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI)
Synonyms:
2-(2-methyl-1,3-benzothiazol-5-yl)acetic acid;5-Benzothiazoleaceticacid, 2-methyl-;CBDivE_003660;Enamine_000112;Cambridge id 5156931;Oprea1_715535;ACMC-20m657;SCHEMBL7231445;CTK0H2476;DTXSID00354934

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5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI) Basic Attributes

Molecular Weight：

207.247

Exact Mass：

207.03500

DSSTox ID：

DTXSID00354934

Characteristics

PSA：

78.43000

XLogP3：

2.23180

Density：

1.381±0.06 g/cm3(Predicted)

Melting Point：

198 °C

Boiling Point：

389.1±17.0 °C(Predicted)

Computed Properties

Molecular Weight:207.25
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:207.03539970
Monoisotopic Mass:207.03539970
Topological Polar Surface Area:78.4
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI)

Basic Attributes
Characteristics
Computed Properties

5-Benzothiazoleaceticacid,2-methyl-(6CI,9CI)

SDS

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