U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H12N2O.2C2H3Cl3O2
Molecular Weight 519.032
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICHLORALPHENAZONE

SMILES

Cc1cc(=O)n(-c2ccccc2)n1C.C(C(Cl)(Cl)Cl)(O)O.C(C(Cl)(Cl)Cl)(O)O

InChI

InChIKey=ATKXDQOHNICLQW-UHFFFAOYSA-N
InChI=1S/C11H12N2O.2C2H3Cl3O2/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;2*3-2(4,5)1(6)7/h3-8H,1-2H3;2*1,6-7H

HIDE SMILES / InChI

Molecular Formula C2H3Cl3O2
Molecular Weight 165.4029
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H12N2O
Molecular Weight 188.2262
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

CHLORAL HYDRATE ANTIPYRINE is a 1:1 mixture of antipyrine with chloral hydrate. It was used as a hypnotic drug known as HYPNAL in the late 19th century.

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Jun 26 16:08:08 UTC 2021
Edited
by admin
on Sat Jun 26 16:08:08 UTC 2021
Record UNII
YYX637R279
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICHLORALPHENAZONE
MART.   MI   USP   VANDF   WHO-DD  
Common Name English
DICHLORALPHENAZONE CIV [USP-RS]
Common Name English
ANTIPYRINE, COMPOUND WITH CHLORAL HYDRATE (1:2)
Common Name English
DICHLORALANTIPYRINE
Common Name English
DICHLORALPHENAZONE [VANDF]
Common Name English
DICHLORALPHENAZONE [WHO-DD]
Common Name English
DICHLORALPHENAZONE CIV
USP-RS  
Common Name English
DICHLORALPHENAZONE [USP]
Common Name English
1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOL-3-ONE, COMPD. WITH 2,2,2-TRICHLORO-1,1-ETHANEDIOL (1:2)
Systematic Name English
DICHLORALPHENAZONE [MI]
Common Name English
DICHLORALPHENAZONE [MART.]
Common Name English
Classification Tree Code System Code
DEA NO. 2467
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
NCI_THESAURUS C29756
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
LIVERTOX 296
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
WHO-VATC QN05CC04
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
WHO-ATC N05CC04
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
Code System Code Type Description
WIKIPEDIA
DICHLORALPHENAZONE
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
CAS
480-30-8
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
EVMPD
SUB13563MIG
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
MERCK INDEX
M4325
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY Merck Index
USP_CATALOG
1187207
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY USP-RS
EPA CompTox
480-30-8
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
NCI_THESAURUS
C87204
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
ECHA (EC/EINECS)
207-546-0
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
DRUG BANK
DB01495
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
PUBCHEM
10188
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
MESH
C007333
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
FDA UNII
YYX637R279
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
LACTMED
Dichloralphenazone
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY
RXCUI
22892
Created by admin on Sat Jun 26 16:08:08 UTC 2021 , Edited by admin on Sat Jun 26 16:08:08 UTC 2021
PRIMARY RxNorm
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
ACTIVE MOIETY