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1-phenyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea

1-phenyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea structure

CAS No:
67526-44-7
Formula:
C13H12N4S
Chemical Name:
1-phenyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea

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1-phenyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea Basic Attributes

Molecular Weight：

256.32600

Exact Mass：

256.07826757

NSC Number：

215613

DSSTox ID：

DTXSID60425932

Characteristics

PSA：

81.40000

XLogP3：

2.86600

Density：

1.2g/cm3

Boiling Point：

412.5ºC

Flash Point：

203.3ºC

Refractive Index：

1.643

Computed Properties

Molecular Weight:256.33
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:256.07826757
Monoisotopic Mass:256.07826757
Topological Polar Surface Area:81.4
Heavy Atom Count:18
Complexity:281
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-phenyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea

Basic Attributes
Characteristics
Computed Properties

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