CAS 39512-50-0 | 1-(2-Chlorophenyl)piperazine | CAS Number 39512-50-0

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39512-50-0 | 1-(2-Chlorophenyl)piperazine

CAS No: 39512-50-0 Catalog No: AG003CU0 MDL No:MFCD00040727

Product Description

Catalog Number:

AG003CU0

Chemical Name:

1-(2-Chlorophenyl)piperazine

CAS Number:

39512-50-0

Molecular Formula:

C10H13ClN2

Molecular Weight:

196.6766

MDL Number:

MFCD00040727

IUPAC Name:

1-(2-chlorophenyl)piperazine

InChI:

InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2

InChI Key:

PWZDJIUQHUGFRJ-UHFFFAOYSA-N

SMILES:

Clc1ccccc1N1CCNCC1

EC Number:

254-480-3

Properties

Complexity:

157

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.678g/mol

Monoisotopic Mass:

196.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

15.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Determination of piperazine-type stimulants in human urine by means of microextraction in packed sorbent and high performance liquid chromatography-diode array detection.	Journal of pharmaceutical and biomedical analysis 20120305
Creation and application of psychoactive designer drugs data library using liquid chromatography with photodiode array spectrophotometry detector and gas chromatography-mass spectrometry.	Talanta 20090215