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5-butyl-1H-pyrazole

5-butyl-1H-pyrazole structure

CAS No:
28998-67-6
Formula:
C7H12N2
Chemical Name:
5-butyl-1H-pyrazole
Synonyms:
3-butylpyrazole; 1H-Pyrazole,3-butyl; 3-Butylpyrazol; 3-butyl-1H-pyrazole; 3-n-Butyl-pyrazol; Pyrazole,3-butyl;Expand

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5-butyl-1H-pyrazole Basic Attributes

Molecular Weight：

124.18400

Exact Mass：

124.100048391 g/mol

DSSTox ID：

DTXSID40183189

Characteristics

PSA：

28.68000

XLogP3：

1.75230

Density：

0.979g/cm3

Boiling Point：

238.1ºC

Flash Point：

100.7ºC

Refractive Index：

1.504

Vapor Pressure：

0.0667mmHg at 25°C

Computed Properties

Molecular Weight:124.18
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:124.100048391
Monoisotopic Mass:124.100048391
Topological Polar Surface Area:28.7
Heavy Atom Count:9
Complexity:73.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-butyl-1H-pyrazole

Basic Attributes
Characteristics
Computed Properties

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