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Details

Stereochemistry ACHIRAL
Molecular Formula C14H10O2
Molecular Weight 210.228
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOXEPINONE

SMILES

O=C1C2=CC=CC=C2COC3=CC=CC=C13

InChI

InChIKey=YUSHFLBKQQILNV-UHFFFAOYSA-N
InChI=1S/C14H10O2/c15-14-11-6-2-1-5-10(11)9-16-13-8-4-3-7-12(13)14/h1-8H,9H2

HIDE SMILES / InChI

Molecular Formula C14H10O2
Molecular Weight 210.228
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Chemistry of clitoral gland secretions of the laboratory rat: assessment of behavioural response to identified compounds.
2001 Jun
6,11-Dihydro-dibenz[b,e]oxepin-11-one.
2009 Dec 16
Spectroscopic and electrochemical analysis of psychotropic drugs.
2009 Jan
Substance Class Chemical
Created
by admin
on Sat Dec 16 04:19:45 UTC 2023
Edited
by admin
on Sat Dec 16 04:19:45 UTC 2023
Record UNII
0H0YJ25O3W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOXEPINONE
Common Name English
6,11-DIHYDRODIBENZ(B,E)OXEPIN-11-ONE
Systematic Name English
USP DOXEPIN RELATED COMPOUND A [USP IMPURITY]
Common Name English
DOXEPIN RELATED COMPOUND A [USP-RS]
Common Name English
DOXEPIN HYDROCHLORIDE IMPURITY A [EP IMPURITY]
Common Name English
DIBENZ(B,E)OXEPIN-11(6H)-ONE
Systematic Name English
DOXEPIN RELATED COMPOUND A [USP IMPURITY]
Common Name English
DOXEPIN RELATED COMPOUND A
USP   USP-RS  
Common Name English
DOXEPIN IMPURITY A
Common Name English
Code System Code Type Description
FDA UNII
0H0YJ25O3W
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
CAS
4504-87-4
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
ECHA (EC/EINECS)
224-820-5
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
PUBCHEM
78259
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID70196368
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
RS_ITEM_NUM
1225511
Created by admin on Sat Dec 16 04:19:46 UTC 2023 , Edited by admin on Sat Dec 16 04:19:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP