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4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione structure

CAS No:
4413-40-5
Formula:
C9H8Cl2N4OS
Chemical Name:
4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Synonyms:
3H-1,2,4-Triazole-3-thione,4-amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-;4H-1,2,4-Triazole-3-thiol,4-amino-5-[(2,4-dichlorophenoxy)methyl]-;4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione;115630-88-1

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4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

291.15700

Exact Mass：

291.16

DSSTox ID：

DTXSID80196051

HScode：

2933990090

Characteristics

PSA：

104.76000

XLogP3：

2.74760

Density：

1.69g/cm3

Melting Point：

185-186 °C

Boiling Point：

419.9ºC at 760 mmHg

Flash Point：

207.7ºC

Refractive Index：

1.736

Computed Properties

Molecular Weight:291.16
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:289.9795875
Monoisotopic Mass:289.9795875
Topological Polar Surface Area:95
Heavy Atom Count:17
Complexity:341
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Amino-5-[(2,4-dichlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

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