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2-[(Phenylmethyl)thio]benzothiazole

2-[(Phenylmethyl)thio]benzothiazole structure

CAS No:
19654-17-2
Formula:
C14H11NS2
Chemical Name:
2-[(Phenylmethyl)thio]benzothiazole
Synonyms:
Benzothiazole,2-[(phenylmethyl)thio]-;Benzothiazole,2-(benzylthio)-;2-[(Phenylmethyl)thio]benzothiazole;2-(Benzylthio)benzothiazole;Benzyl 2-benzothiazolyl sulfide;2-Benzothiazolyl benzyl sulfide;2-Benzylsulfanyl-benzothiazole;2-(Benzylthio)benzo[d]thiazole;2-Benzylsulfanyl-1,3-benzothiazole;134532-00-6

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2-[(Phenylmethyl)thio]benzothiazole Basic Attributes

Molecular Weight：

257.4 g/mol

Exact Mass：

257.37

DSSTox ID：

DTXSID70333276

Characteristics

PSA：

66.4 Å²

Melting Point：

40-41 °C

Boiling Point：

168-172 °C @ Press: 3 Torr

Computed Properties

Molecular Weight:257.4
XLogP3:4.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:257.03329170
Monoisotopic Mass:257.03329170
Topological Polar Surface Area:66.4
Heavy Atom Count:17
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(Phenylmethyl)thio]benzothiazole

Basic Attributes
Characteristics
Computed Properties

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