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4-(METHYLTHIO)-1H-IMIDAZOLE

4-(METHYLTHIO)-1H-IMIDAZOLE structure

CAS No:
83553-60-0
Formula:
C4H6N2S
Chemical Name:
4-(METHYLTHIO)-1H-IMIDAZOLE
Synonyms:
4-(Methylthio)-1H-imidazole;5-methylsulfanyl-1H-imidazole;4-(Methylthio)imidazole;5-(methylsulfanyl)-1H-imidazole;5-(methylthio)-1H-Imidazole;4-(methylsulfanyl)-1H-imidazole;PubChem14136;SCHEMBL1145733;4-(Methylthio);-1H-imidazole;SCHEMBL10934277

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4-(METHYLTHIO)-1H-IMIDAZOLE Basic Attributes

Molecular Weight：

114.166

Exact Mass：

114.02500

DSSTox ID：

DTXSID30517671

HScode：

2933290090

Characteristics

PSA：

XLogP3：

0.9

Density：

1.23g/cm3

Boiling Point：

329.2°C at 760 mmHg

Flash Point：

152.9ºC

Refractive Index：

1.588

Computed Properties

Molecular Weight:114.17
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:114.02516937
Monoisotopic Mass:114.02516937
Topological Polar Surface Area:54
Heavy Atom Count:7
Complexity:57.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(METHYLTHIO)-1H-IMIDAZOLE

Basic Attributes
Characteristics
Computed Properties

4-(METHYLTHIO)-1H-IMIDAZOLE

SDS

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