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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H9NO
Molecular Weight 195.2167
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBENZ(B,F)(1,4)OXAZEPINE

SMILES

O1C2=CC=CC=C2N=CC3=C1C=CC=C3

InChI

InChIKey=NPUACKRELIJTFM-UHFFFAOYSA-N
InChI=1S/C13H9NO/c1-3-7-12-10(5-1)9-14-11-6-2-4-8-13(11)15-12/h1-9H

HIDE SMILES / InChI

Molecular Formula C13H9NO
Molecular Weight 195.2167
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Tear gases and irritant incapacitants. 1-chloroacetophenone, 2-chlorobenzylidene malononitrile and dibenz[b,f]-1,4-oxazepine.
2003
Synthetic utilization of polynitroaromatic compounds. 3. Preparation of substituted dibenz[b,f][1,4]oxazepine-11(10H)-ones from 2,4,6-trinitrobenzoic acid via nucleophilic displacement of nitro groups.
2005 Nov 11
Medical management of the traumatic consequences of civil unrest incidents: causation, clinical approaches, needs and advanced planning criteria.
2006
Tear gasses CN, CR, and CS are potent activators of the human TRPA1 receptor.
2008 Sep 1
N-Cyclo-hexyl-5H,7H-13,15-dimethyl-9-nitro-5-oxophenanthrido[4,4a,5-bc][1,4]benzoxazepine-7-carboxamide.
2009 Jul 25
Molecular modeling studies on 11H-dibenz[b,e]azepine and dibenz[b,f][1,4]oxazepine derivatives as potent agonists of the human TRPA1 receptor.
2010 Dec 17
Analogues of morphanthridine and the tear gas dibenz[b,f][1,4]oxazepine (CR) as extremely potent activators of the human transient receptor potential ankyrin 1 (TRPA1) channel.
2010 Oct 14
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:35:31 UTC 2023
Edited
by admin
on Fri Dec 15 17:35:31 UTC 2023
Record UNII
C1Q77A87V1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIBENZ(B,F)(1,4)OXAZEPINE
HSDB  
Systematic Name English
NSC-293779
Code English
DIBENZ(B,F)(1,4)OXAZEPINE [HSDB]
Common Name English
Code System Code Type Description
NSC
293779
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
PUBCHEM
9213
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
HSDB
7598
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID8059764
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
FDA UNII
C1Q77A87V1
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
CAS
257-07-8
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY
WIKIPEDIA
CR gas
Created by admin on Fri Dec 15 17:35:32 UTC 2023 , Edited by admin on Fri Dec 15 17:35:32 UTC 2023
PRIMARY