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2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide

2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide structure

CAS No:
19201-39-9
Formula:
C17H16N2OS2
Chemical Name:
2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide
Synonyms:
Ethanethioamide,2-(6-methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenyl-;Δ2,α-Benzothiazolineacetanilide,6-methoxy-3-methylthio-;2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide

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2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide Basic Attributes

Molecular Weight：

328.45200

Exact Mass：

328.45

EC Number：

242-876-9

Characteristics

PSA：

86.52000

XLogP3：

3.82250

Density：

1.373g/cm3

Melting Point：

216-217 °C

Boiling Point：

454ºC

Flash Point：

228.4ºC

Refractive Index：

1.773

Vapor Pressure：

1.97E-08mmHg at 25°C

Computed Properties

Molecular Weight:328.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:328.07040549
Monoisotopic Mass:328.07040549
Topological Polar Surface Area:81.9
Heavy Atom Count:22
Complexity:434
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(6-Methoxy-3-methyl-2(3H)-benzothiazolylidene)-N-phenylethanethioamide

Basic Attributes
Characteristics
Computed Properties

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