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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H5ClO
Molecular Weight 140.567
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-CHLOROBENZALDEHYDE

SMILES

ClC1=C(C=O)C=CC=C1

InChI

InChIKey=FPYUJUBAXZAQNL-UHFFFAOYSA-N
InChI=1S/C7H5ClO/c8-7-4-2-1-3-6(7)5-9/h1-5H

HIDE SMILES / InChI

Molecular Formula C7H5ClO
Molecular Weight 140.567
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Major differences exist in the function and tissue-specific expression of human aflatoxin B1 aldehyde reductase and the principal human aldo-keto reductase AKR1 family members.
1999 Oct 15
Metabolic engineering of bacteria for environmental applications: construction of Pseudomonas strains for biodegradation of 2-chlorotoluene.
2001 Feb 13
Synthesis, spectral and antibacterial studies of binuclear titanium(IV) / zirconium(IV) complexes of piperazine dithiosemicarbazones.
2003
Monitoring of the principal carbonyl compounds involved in malolactic fermentation of wine by solid-phase microextraction and positive ion chemical ionization GC/MS analysis.
2005 Dec
Anisotropy shift and Raman bandwidth studies in carbonyl containing molecule o-chlorobenzaldehyde: role of repulsive forces.
2005 Dec
Classical and three-dimensional QSAR for the inhibition of [3H]ponasterone A binding by diacylhydrazine-type ecdysone agonists to insect Sf-9 cells.
2005 Feb 15
Synthesis of 1-aryl-1H-indazoles via palladium-catalyzed intramolecular amination of aryl halides.
2005 Jan 21
Vibrational spectra of partially oriented molecules having two conformers in nematic and isotropic solutions: furfural and 2-chlorobenzaldehyde.
2005 May
(2-Chloro-phen-yl)(diphenyl-phosphor-yl)methanol.
2007 Dec 12
Ethyl 2-benzyl-sulfanyl-7-(2-chloro-phen-yl)-5-methyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxyl-ate.
2007 Dec 6
1,2-Bis(2-chloro-benzyl-idene)hydrazine.
2007 Dec 6
Counteracting expression deficiencies by anticipating posttranslational modification of PaHNL5-L1Q-A111G by genetic engineering.
2007 Mar 30
2,2'-Dichloro-1,1'-[(butane-1,4-diyldi-oxy)bis-(nitrilo-methyl-idyne)]dibenzene.
2008 Aug 6
2-(4-Chloro-benzo-yl)-3,6-dimethoxy-naphthalene.
2008 Feb 22
Ethyl 6-(2-chloro-phen-yl)-4-methyl-1-(3-oxobut-yl)-2-thioxo-1,2,3,6-tetra-hydro-pyrimidine-5-carboxyl-ate.
2008 Jan 4
(E)-1-(4-Bromo-phen-yl)-3-(2-chloro-phen-yl)prop-2-en-1-one.
2008 Jul 12
2,2'-Dichloro-1,1'-[(propane-1,3-diyldi-oxy)bis-(nitrilo-methyl-idyne)]dibenzene.
2008 Jul 19
2,4-Bis(2-chloro-phen-yl)-3-aza-bicyclo-[3.3.1]nonan-9-one.
2008 Jul 26
N'-(2-Chloro-benzyl-idene)-3,4,5-tri-methoxy-benzohydrazide methanol solvate.
2008 Jul 31
(E)-3-(2-Chloro-phen-yl)-1-(2,4-dichloro-phen-yl)prop-2-en-1-one.
2008 May 17
(E)-3-(2-Chloro-phen-yl)-1-(4-nitro-phen-yl)prop-2-en-1-one.
2008 May 3
(E)-3-(2-Chloro-phen-yl)-1-(4-chloro-phen-yl)prop-2-en-1-one.
2008 May 30
5-Acetyl-4-(2-chloro-phen-yl)-6-methyl-3,4-dihydro-pyrimidin-2(1H)-one.
2008 Nov 29
1-(2-Chloro-benzyl-idene)-2-(2,4-dinitro-phen-yl)hydrazine.
2008 Oct 18
(E)-1-(4-Amino-phen-yl)-3-(2-chloro-phen-yl)prop-2-en-1-one.
2008 Sep 27
(E)-4-Bromo-N'-(2-chloro-benzyl-idene)benzohydrazide.
2009 Apr 18
(E)-3-Bromo-N'-(4-methoxy-benzyl-idene)benzohydrazide methanol solvate.
2009 Aug 8
2,4-Bis(4-chloro-phen-yl)-3-aza-bicyclo-[3.3.1]nonan-9-one.
2009 Feb 25
2-Amino-5-nitro-phenyl 2-chloro-phenyl ketone.
2009 Jul 18
(E)-3-Bromo-N'-(2-chloro-benzyl-idene)benzohydrazide.
2009 Jun 27
2,4-Bis(3-chloro-phen-yl)-3-aza-bicyclo-[3.3.1]nonan-9-one.
2009 Mar 25
Investigation of catalytic characterization of two-dimensional molecular space with regular ammonium and pyridine groups.
2009 May 19
Photoinduced degradation of the herbicide clomazone model reactions for natural and technical systems.
2009 May-Jun
Chiral catalysts dually functionalized with amino acid and Zn2+ complex components for enantioselective direct aldol reactions inspired by natural aldolases: design, synthesis, complexation properties, catalytic activities, and mechanistic study.
2009 Oct 12
Surface functionalization, oxygen depth profiles, and wetting behavior of PET treated with different nitrogen plasmas.
2010 Apr
N'-(2-Chloro-benzyl-idene)-2-(3,4-dimethyl-5,5-dioxo-2H,4H-pyrazolo-[4,3-c][1,2]benzothia-zin-2-yl)acetohydrazide.
2010 Dec 24
3,9-Bis(2-chloro-phen-yl)-2,4,8,10-tetra-oxaspiro-[5.5]undeca-ne.
2010 Jan 23
Selective monoacylation of ferrocene with bulky acylating agents over mesoporous sieve AlKIT-5.
2010 Jul 12
Synthesis of some new pyrimido[2',1':2,3]thiazolo[4,5-b]quinoxaline derivatives as anti-inflammatory and analgesic agents.
2010 May
3-Benzyl-6-(2-chloro-benzo-yl)-1,3-benzoxazol-2(3H)-one.
2010 Nov 17
Characterization of a novel NADPH-dependent oxidoreductase from Gluconobacter oxydans.
2010 Oct
Characterization of a broad-range aldehyde dehydrogenase involved in alkane degradation in Geobacillus thermodenitrificans NG80-2.
2010 Oct 20
2,7-Dimeth-oxy-1,8-bis-(4-phen-oxy-benzo-yl)naphthalene.
2010 Oct 23
Eth-oxy-carbonyl-methyl 3-(4-chloro-benzyl-idene)dithio-carbazate.
2010 Sep 11
Ethyl 7-(2-chloro-phen-yl)-5-trifluoro-meth-yl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxyl-ate.
2010 Sep 25
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 02:15:42 GMT 2023
Edited
by admin
on Sat Dec 16 02:15:42 GMT 2023
Record UNII
QHR24X1LXK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-CHLOROBENZALDEHYDE
Common Name English
NSC-15347
Code English
CHLOROBENZALDEHYDE, O-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID5024764
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
CAS
89-98-5
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
FDA UNII
QHR24X1LXK
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
PUBCHEM
6996
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
NSC
15347
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
WIKIPEDIA
2-Chlorobenzaldehyde
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-956-3
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
HSDB
2727
Created by admin on Sat Dec 16 02:15:42 GMT 2023 , Edited by admin on Sat Dec 16 02:15:42 GMT 2023
PRIMARY
Related Record Type Details
other
Related Record Type Details
PARENT -> IMPURITY