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4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol,hydrate,dihydrobromide

4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol,hydrate,dihydrobromide structure

CAS No:
102366-99-4
Formula:
C19H28Br2N2O3
Chemical Name:
4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol,hydrate,dihydrobromide
Synonyms:
1-o-Tolyl-4-(3,4-dihydroxyphenethyl)piperazine dihydrobromide monohydrate; Pyrocatechol,4-(2-(4-(o-tolyl)-1-piperazinyl)ethyl)-,dihydrobromide,hydrate; 4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol hydrate dihydrobromide;

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4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol,hydrate,dihydrobromide Basic Attributes

Molecular Weight：

492.24500

Exact Mass：

492.04462

DSSTox ID：

DTXSID90144947

Characteristics

PSA：

56.17000

XLogP3：

4.62570

Boiling Point：

504ºC

Flash Point：

264.8ºC

Vapor Pressure：

1.23E-10mmHg at 25°C

Computed Properties

Molecular Weight:492.2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:492.04462
Monoisotopic Mass:490.04667
Topological Polar Surface Area:47.9
Heavy Atom Count:26
Complexity:357
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes

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Guide of 4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]benzene-1,2-diol,hydrate,dihydrobromide

Basic Attributes
Characteristics
Computed Properties

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