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Details

Stereochemistry ACHIRAL
Molecular Formula C7H11Cl3O4
Molecular Weight 265.519
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTHRICHLORAL

SMILES

OCC1(CO)COC(OC1)C(Cl)(Cl)Cl

InChI

InChIKey=QMSJBEPHXPSJPT-UHFFFAOYSA-N
InChI=1S/C7H11Cl3O4/c8-7(9,10)5-13-3-6(1-11,2-12)4-14-5/h5,11-12H,1-4H2

HIDE SMILES / InChI
Penthrichloral has sedative and hypnotic properties similar to those of chloral hydrate but it is more palatable and causes less gastric irritation. Penthrichloral is a binder for polyester fibers.

Approval Year

PubMed

PubMed

TitleDatePubMed
[Clinical results obtained with penthrichloral, a new sedative hypnotic].
1961 Feb
Designing sedative/hypnotic compounds from a novel substructural graph-theoretical approach.
1998 Nov
Name Type Language
PENTHRICHLORAL
INN  
INN  
Official Name English
5,5-DI(HYDROXYMETHYL)-2-TRICHLOROMETHYL-1,3-DIOXAN
Systematic Name English
penthrichloral [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29756
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
Code System Code Type Description
SMS_ID
100000082513
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
PRIMARY
CAS
5684-90-2
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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FDA UNII
ADN850L91I
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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ChEMBL
CHEMBL2103943
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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ECHA (EC/EINECS)
227-151-7
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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INN
901
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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NCI_THESAURUS
C66343
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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PUBCHEM
71839
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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EPA CompTox
DTXSID7046251
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
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EVMPD
SUB09692MIG
Created by admin on Fri Dec 15 16:25:43 GMT 2023 , Edited by admin on Fri Dec 15 16:25:43 GMT 2023
PRIMARY