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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O2
Molecular Weight 136.1479
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2'-HYDROXYACETOPHENONE

SMILES

CC(=O)C1=CC=CC=C1O

InChI

InChIKey=JECYUBVRTQDVAT-UHFFFAOYSA-N
InChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3

HIDE SMILES / InChI
Molecular Formula C8H8O2
Molecular Weight 136.1479
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

2015
471
PubMed

PubMed

TitleDatePubMed
Reaction coordinate analysis for beta-diketone cleavage by the non-heme Fe2+-dependent dioxygenase Dke1.
2005 Sep 7
Polymetallic clusters of iron(III) with derivatised salicylaldoximes.
2008 Apr 21
N'-[1-(2-Hydroxy-phen-yl)ethyl-idene]benzene-sulfonohydrazide.
2008 Apr 26
N'-[1-(2-Hydroxy-phen-yl)ethyl-idene]-2-nitro-benzohydrazide methanol solvate.
2009 Feb 25
{2-[1-(2-Amino-2-methyl-propyl-imino)eth-yl]phenolato-κN,N',O}dioxidovanadium(V).
2009 Jan 14
(2-Acetyl-phenolato)(2,2'-bipyridine)nitratocopper(II).
2009 Oct 23
Patents

Patents

05057525
24
05703075
2
05767285
2
07067534
14
07638527
1
JPS57145870A
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:59:41 GMT 2023
Edited
by admin
on Fri Dec 15 18:59:41 GMT 2023
Record UNII
3E533Z76W0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2'-HYDROXYACETOPHENONE
Systematic Name English
O-HYDROXYPHENYL METHYL KETONE
Common Name English
NSC-16933
Code English
O-ACETYL PHENOL
Systematic Name English
1-(2-HYDROXYPHENYL)ETHAN-1-ONE
Systematic Name English
PARACETAMOL IMPURITY I [EP IMPURITY]
Common Name English
2-HYDROXYACETOPHENONE [FHFI]
Common Name English
FEMA NO. 3548
Code English
Code System Code Type Description
MESH
C087908
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
FDA UNII
3E533Z76W0
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
JECFA MONOGRAPH
600
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
PUBCHEM
8375
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
CHEBI
145716
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
RXCUI
1664428
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY RxNorm
CAS
118-93-4
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
DAILYMED
3E533Z76W0
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
NSC
16933
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
204-288-0
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID7040285
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
Related Record Type Details
Structure of ACETAMINOPHEN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966