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methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate

methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate structure

CAS No:
876936-67-3
Formula:
C11H10ClNO2S2
Chemical Name:
methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate
Synonyms:
NSC691045;methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate;CHEMBL1986770;HMS1779N10;AKOS017004240;MCULE-8531801063;NSC-691045;NCI60_032674;Z18552900;Methyl 2-[2'-(5'-Chlorobenzothiazolyl)thio]propanoate;Methyl 2-((5-chloro-1,3-benzothiazol-2-yl)thio)propanoate;876936-67-3

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methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate Basic Attributes

Molecular Weight：

287.8 g/mol

Exact Mass：

286.9841486 g/mol

NSC Number：

691045

Characteristics

PSA：

92.7 Å²

Computed Properties

Molecular Weight:287.8
XLogP3:4.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:286.9841486
Monoisotopic Mass:286.9841486
Topological Polar Surface Area:92.7
Heavy Atom Count:17
Complexity:293
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanoate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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