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5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole

5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole structure

CAS No:
94201-87-3
Formula:
C8H7N5O2S
Chemical Name:
5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole
Synonyms:
1H-Tetrazole,5-(methylthio)-1-(4-nitrophenyl)-;1H-Tetrazole,5-(methylthio)-1-(p-nitrophenyl)-;5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole;5-Methylthio-1-(4-nitrophenyl)tetrazole

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5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole Basic Attributes

Molecular Weight：

237.23800

Exact Mass：

237.24

EC Number：

303-677-3

UNII：

U127ZN21WP

DSSTox ID：

DTXSID50241027

HScode：

2933990090

Characteristics

PSA：

114.72000

XLogP3：

1.81560

Density：

1.59g/cm3

Melting Point：

147-148 °C

Boiling Point：

454.4ºC

Flash Point：

228.6ºC

Refractive Index：

1.754

Computed Properties

Molecular Weight:237.24
XLogP3:1.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:237.03204566
Monoisotopic Mass:237.03204566
Topological Polar Surface Area:115
Heavy Atom Count:16
Complexity:253
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: methyl acetate; boric acid; phenylacetaldehyde; tributyl phosphate; t butanol; cefipime

Guide of 5-(Methylthio)-1-(4-nitrophenyl)-1H-tetrazole

Basic Attributes
Characteristics
Computed Properties

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