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1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline

1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline structure

CAS No:
126921-49-1
Formula:
C22H25N3
Chemical Name:
1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline

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1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline Basic Attributes

Molecular Weight：

331.45400

Exact Mass：

331.204847810

DSSTox ID：

DTXSID30155335

Characteristics

PSA：

19.37000

XLogP3：

3.91080

Density：

1.124g/cm3

Boiling Point：

498.6ºC

Flash Point：

255.3ºC

Refractive Index：

1.628

Vapor Pressure：

4.47E-10mmHg at 25°C

Computed Properties

Molecular Weight:331.5
XLogP3:4.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:331.204847810
Monoisotopic Mass:331.204847810
Topological Polar Surface Area:19.4
Heavy Atom Count:25
Complexity:404
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]isoquinoline

Basic Attributes
Characteristics
Computed Properties

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