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5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI)

5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI) structure

CAS No:
224947-53-9
Formula:
C10H6N2O2S
Chemical Name:
5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI)
Synonyms:
5-benzothiazolecarboxylic acid,2-(cyanomethyl)-;ZINC45236279

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5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI) Basic Attributes

Molecular Weight：

218.23184

Exact Mass：

218.015

Characteristics

PSA：

102

XLogP3：

1.6

Computed Properties

Molecular Weight:218.23
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:218.01499861
Monoisotopic Mass:218.01499861
Topological Polar Surface Area:102
Heavy Atom Count:15
Complexity:312
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI)

Basic Attributes
Characteristics
Computed Properties

5-Benzothiazolecarboxylicacid,2-(cyanomethyl)-(9CI)

SDS

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