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Dichloralphenazone

Dichloralphenazone structure

CAS No:
480-30-8
Formula:
C11H12N2O.2C2H3Cl3O2
Chemical Name:
Dichloralphenazone
Synonyms:
3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-2-phenyl-,compd. with 2,2,2-trichloro-1,1-ethanediol (1:2);Antipyrine,compd. with chloral hydrate (1:2);Chloral hydrate,compd. with antipyrine (2:1);1,1-Ethanediol,2,2,2-trichloro-,compd. with 1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one (2:1);Dichloralphenazone;Dichloralantipyrine;Sedor;Sominat;Welldorm;Ibiodorm;Kloralfenazon;Dichloralantipyrin;Dormuphar;Bonadorm;Bihypnal;Dormwell
Categories:
Organic Chemistry > Heterocyclic Ring

Description

Dichloralphenazone is a DEA Schedule IV controlled substance. Substances in the DEA Schedule IV have a low potential for abuse relative to substances in Schedule III.|Dichloralphenazone is a sedative composed of chloral hydrate and phenazone. It is typically found in combination products Nodolor and Midrin containing [isometheptene] and [acetaminophen] used for the relief of tension and vascular headaches. It is a US Schedule IV drug and its clinical use is limited.

Dichloralphenazone Basic Attributes

Molecular Weight：

519.018

Exact Mass：

515.93500

EC Number：

207-546-0

UNII：

YYX637R279

DEA Code Number：

2467

DSSTox ID：

DTXSID2022919

ATC Code：

N - Nervous system

HScode：

2933194350

Characteristics

PSA：

105

XLogP3：

2.81900

Melting Point：

68 °C

Boiling Point：

319ºC at 760 mmHg

Vapor Pressure：

0.000348mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

Precautionary statement(s)：

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

dichloralantipyrine

DEA Controlled Substances：

Dichloralphenazone|Midrin, dichloralantipyrine|2467|Schedule IV - Substances in the DEA Schedule IV have a low potential for abuse relative to substances in Schedule III.|No

Dichloralphenazone Use and Manufacturing

Sedative-hypnotic.

Computed Properties

Molecular Weight:519.0
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:517.931738
Monoisotopic Mass:515.934688
Topological Polar Surface Area:105
Heavy Atom Count:28
Complexity:323
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes