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3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile

3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile structure

CAS No:
16588-67-3
Formula:
C20H21N5O2S2
Chemical Name:
3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile
Synonyms:
Propanenitrile,3-[ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]-;Propionitrile,3-[N-ethyl-4-[[6-(methylsulfonyl)-2-benzothiazolyl]azo]-m-toluidino]-;Propanenitrile,3-[ethyl[3-methyl-4-[[6-(methylsulfonyl)-2-benzothiazolyl]azo]phenyl]amino]-;3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile

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3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile Basic Attributes

Molecular Weight：

427.54300

Exact Mass：

427.54

EC Number：

240-646-2

DSSTox ID：

DTXSID1051775

Characteristics

PSA：

135.40000

XLogP3：

6.24438

Density：

1.32g/cm3

Boiling Point：

695.7ºC at 760mmHg

Flash Point：

374.5ºC

Refractive Index：

1.659

Vapor Pressure：

3.34E-19mmHg at 25°C

3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile Use and Manufacturing

Manufacturing Info：

Propanenitrile, 3-[ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]-: ACTIVE

Computed Properties

Molecular Weight:427.5
XLogP3:4.3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:427.11366728
Monoisotopic Mass:427.11366728
Topological Polar Surface Area:135
Heavy Atom Count:29
Complexity:729
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[Ethyl[3-methyl-4-[2-[6-(methylsulfonyl)-2-benzothiazolyl]diazenyl]phenyl]amino]propanenitrile

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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