 Home > Encyclopedia > 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride

2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride

2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride structure

CAS No:
16785-31-2
Formula:
C26H38Cl2N2O4
Chemical Name:
2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride

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2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride Basic Attributes

Molecular Weight：

513.49700

Exact Mass：

512.2208631 g/mol

DSSTox ID：

DTXSID60168413

Characteristics

PSA：

84.24000

XLogP3：

3.94130

Boiling Point：

644.5ºC

Flash Point：

343.6ºC

Vapor Pressure：

1.72E-17mmHg at 25°C

Computed Properties

Molecular Weight:513.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:512.2208631
Monoisotopic Mass:512.2208631
Topological Polar Surface Area:84.2
Heavy Atom Count:34
Complexity:563
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone,dihydrochloride

Basic Attributes
Characteristics
Computed Properties

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