2,4-Dichlorophenoxyacetic Acid

Details

• Internal ID: b2d57038-b96b-4c3e-b9bf-f80d001bbf03
• Taxonomy: Benzenoids > Benzene and substituted derivatives > Phenoxyacetic acid derivatives > Chlorophenoxyacetates
• IUPAC Name: 2-(2,4-dichlorophenoxy)acetic acid
• SMILES (Canonical): C1=CC(=C(C=C1Cl)Cl)OCC(=O)O
• SMILES (Isomeric): C1=CC(=C(C=C1Cl)Cl)OCC(=O)O
• InChI: InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
• InChI Key: OVSKIKFHRZPJSS-UHFFFAOYSA-N
• Popularity: 23,774 references in papers

Physical and Chemical Properties

• Molecular Formula: C₈H₆Cl₂O₃
• Molecular Weight: 221.03 g/mol
• Exact Mass: 219.9693994 g/mol
• Topological Polar Surface Area (TPSA): 46.50 Ų
• XlogP: 2.80

Synonyms

• 94-75-7
• 2-(2,4-dichlorophenoxy)acetic acid
• 2,4-D
• (2,4-Dichlorophenoxy)acetic acid
• Rhodia
• Fernimine
• Netagrone
• Vergemaster
• Agrotect
• Amoxone
• Dicopur
• Dormone
• Tributon
• Estone
• Ipaner
• Moxone
• Phenox
• Pielik
• B-Selektonon
• Crop rider
• Pennamine D
• Weed-Rhap
• Weed-ag-bar
• Weedone lv4
• Chloroxone
• Herbidal
• Weedatul
• Weedez wonder bar
• Weedtrol
• Ferxone
• Weed-B-gon
• Emulsamine bk
• Verton 2D
• Brush-rhap
• Mota Maskros
• Envert dt
• Foredex 75
• Lawn-keep
• Vidon 638
• Weed tox
• Esteron 76 BE
• Emulsamine E-3
• Macrondray
• Plantgard
• Miracle
• Ded-Weed LV-69
• Netagrone 600
• Superormone concentre
• Esteron 44 weed killer
• Debroussaillant 600
• Acme LV 4
• Emulsamine
• Barrage
• Deherban
• Pennamine
• Acetic acid, (2,4-dichlorophenoxy)-
• Dormon
• Moxon
• Citrus fix
• Dacamine
• Diclordon
• Esterone
• Hedonal (the herbicide)
• Weedar
• Dichlorophenoxyacetic acid
• Salvo
• Verton 38
• U 46DP
• Verton D
• Vertron 2D
• Aminopielik 50SL
• Acide 2,4-dichloro phenoxyacetique
• Weedar-64
• 2,4-Dwuchlorofenoksyoctowy kwas
• Farmco
• Red Devil Dry Weed Killer
• Esterone four
• Visko-rhap
• BH 2,4-D
• Chipco turf herbicide D
• Acido(2,4-dicloro-fenossi)-acetico
• ENT 8,538
• Kyselina 2,4-dichlorfenoxyoctova
• Esteron brush killer
• U-5043
• DMA-4
• Envert 171
• 2,4-PA
• Spritz-hormin/2,4-D
• CHEBI:28854
• DTXSID0020442
• NSC 423
• NSC-2925
• DTXCID80442
• 2577AQ9262
• 2,4 Dichlorophenoxyacetic Acid
• 2,4-dichlorophenoxyacetic acid (2,4-d)
• RefChem:82391
• 2,4-dichlorphenoxyacetic acid
• 202-361-1
• Aqua-Kleen
• Dicotox
• Verton
• Fernesta
• 2,4-D acid
• Planotox
• Croprider
• Monosan
• Rcra waste number U240
• Agricorn D
• Silvaprop 1
• Visko-rhap low volatile 4l
• Visko-rhap low drift herbicides
• Weed-Rhap A-4
• Weed-Rhap B-4
• Hivol-44
• Caswell No. 315
• Acme LV 6
• Weed-Rhap B-266
• (2,4-Dichlorophenyloxy)acetic acid
• R-H Weed Rhap 20
• Weed-Rhap LV-4-0
• Tiller S
• Weed-Rhap I-3.34
• Hedonal, herbicide
• Esteron 99
• (2,4-Dichloor-fenoxy)-azijnzuur
• De-Pester Ded-Weed LV-2
• (2,4-Dichlor-phenoxy)-essigsaeure
• Phenoxyacetic acid, 2,4-dichloro-
• Scott's 4-XD Weed Control
• CCRIS 949
• MFCD00004300
• Dezormon
• HSDB 202
• Huragan
• Uniso
• Kwas 2,4-dwuchlorofenoksyoctowy
• 2,4-Dichlorophenoxyethanoic acid
• Barrage HF
• Kwasu 2,4-dwuchlorofenoksyoctowego
• Atlas D
• NSC 2925
• Weedone 100 Emulsifiable [Canada]
• (Dichlorophenoxy)acetic acid
• Acme amine 4
• EPA Pesticide Chemical Code 030001
• Acme butyl ester 4
• Verton 2-D
• 2,4-D Mecoprop
• (2,4-Dichlorphenoxy)acetic acid
• 2,4-Dichlorophenoxy Acetic Acid
• AI3-08538
• Spritz-hormit/2,4-D
• 2,4-D (2,4-dichlorophenoxyacetic acid)
• 2,4-Dwuchlorofenoksyoctowy kwas [Polish]
• (2,4-Dichloor-fenoxy)-azijnzuur [Dutch]
• (2,4-Dichlor-phenoxy)-essigsaeure [German]
• Acide 2,4-dichloro phenoxyacetique [French]
• Butoxy-D 3: 1 Liquid emulsifiable Brushkiller LV96 [Canada]
• 2,4-Dichlorophenyloxyacetic Acid
• Acido(2,4-dicloro-fenossi)-acetico [Italian]
• 64296-19-1
• Macondray
• CAS-94-75-7
• CFA
• SMR000135639
• 2,4-Dwuchlorofenoksyoctowy kwas (POLISH)
• (2,4-Dichloor-fenoxy)-azijnzuur (DUTCH)
• 2,4-d ((2,4-dichlorophenoxy)acetic acid)
• (2,4-Dichlor-phenoxy)-essigsaeure (GERMAN)
• 2,4-D [BSI:ISO]
• Acide 2,4-dichloro phenoxyacetique (FRENCH)
• Acido(2,4-dicloro-fenossi)-acetico (ITALIAN)
• Green Cross Weed-No-More "80"
• EINECS 202-361-1
• RCRA waste no. U240
• BRN 1214242
• Isadiamineyeom
• Basalcoat
• Kwas 2,4-dwuchlorofenoksyoctowy [Polish]
• Kyselina 2,4-dichlorfenoxyoctova [Czech]
• Monosan herbi
• Green Cross Weed-No-More 80
• Kwasu 2,4-dwuchlorofenoksyoctowego [Polish]
• Planotox Plantgard
• UNII-2577AQ9262
• 2,4-D [Chlorophenoxy herbicides]
• Hedonal (herbicide)
• Spectrum_001853
• 2,4-D (Standard)
• SpecPlus_000464
• Spectrum2_001855
• Spectrum3_000832
• Spectrum4_000672
• Spectrum5_001978
• Chipco turf herbicide 'd'
• WLN: QV1OR BG DG
• Macondray Macrondray Miracle
• 2,4-Dichlorphenoxyessigsaure
• SCHEMBL27783
• 2,4-D, analytical standard
• BSPBio_002383
• KBioGR_001103
• KBioSS_002370
• SPECTRUM330040
• 2,4-Dichlorphenoxyessigsaeure
• 4-06-00-00908 (Beilstein Handbook Reference)
• MLS001055481
• MLS001066378
• BIDD:ER0676
• Chipco turf herbicide ''D''
• DivK1c_006560
• Butoxy-D 3: 1 Liquid emulsifiable Brushkiller LV96
• SPBio_001670
• CHEMBL367623
• orb1306497
• (2,4-Dichlorphenoxy)essigsaure
• 2,4-dichloro-phenoxyacetic acid
• 2,4-dichlorophenoxy-acetic acid
• SCHEMBL11639157
• (2,4-Dichlorphenoxy)essigsaeure
• Chipco turf herbicide quot DQuot
• KBio1_001504
• KBio2_002366
• KBio2_004934
• KBio2_007502
• KBio3_001883
• NSC2925
• 2,4-D [HSDB]
• 2,4-D [IARC]
• HMS2749P17
• (2,4-dichloro-phenoxy)acetic acid
• (2,4-dichlorophenoxy)-acetic acid
• 2,4-dichlorophenoxy-1-acetic acid
• (2, 4-Dichlorophenoxy)acetic acid
• 2,4-D [ISO]
• MSK22017
• Tox21_201751
• Tox21_300890
• (2,4-dichloro-phenoxy)-acetic acid
• BBL007778
• BDBM50486213
• CCG-39393
• HY-18572R
• SBB040531
• STK386452
• Chipco turf herbicide "D" Chloroxone
• 2,4-D 10 microg/mL in Acetonitrile
• 2,4-D 1000 microg/mL in Acetone
• 2,4-Dichlorophenoxyacetic acid, 97%
• AKOS000103940
• 2,4-D [MI]
• AC-3256
• BS-4286
• FD21679
• NSC 190751
• 2,4-D 100 microg/mL in Acetonitrile
• Acetic acid, 2-(2,4-dichlorophenoxy)-
• NCGC00090713-01
• NCGC00090713-03
• NCGC00090713-04
• NCGC00090713-05
• NCGC00090713-06
• NCGC00090713-07
• NCGC00090713-08
• NCGC00090713-09
• NCGC00254794-01
• NCGC00259300-01
• DICHLOROPHENOXYACETIC ACID [MART.]
• HY-18572
• DB-057528
• 2,4-D, PESTANAL(R), analytical standard
• CS-0008188
• D0396
• NS00000247
• ST45161430
• EN300-16559
• 94D757
• C03664
• D72463
• Q209222
• SR-01000596969
• (2,4-dichlorophenoxy)acetic acid (ACD/Name 4.0)
• 2,4-D, certified reference material, TraceCERT(R)
• SR-01000596969-1
• 2-(2,4-Dichlorophenoxy)acetic acid;2,4-D;Diclordon
• BRD-K01473791-001-02-2
• BRD-K01473791-001-06-3
• Acetic acid, (2,4-dichlorophenoxy)- (7CI,8CI,9CI)
• F0850-6564
• Visko-rhap low drift herbicides Visko-rhap low volatile 4l
• 2,4-D ((2,4-Dichlorophenoxy)acetic acid) 10 microg/mL in Acetonitrile
• 2,4-D ((2,4-Dichlorophenoxy)acetic acid) 100 microg/mL in Acetonitrile
• 2,4-D ((2,4-Dichlorophenoxy)acetic acid) 1000 microg/mL in Acetone
• 2,4-Dichlorophenoxyacetic acid, plant cell culture tested, >=98%, crystalline
• InChI=1/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

CHEMBL ID	UniProt ID	Name	Min activity	Assay type	Source
CHEMBL1075138	Q9NUW8	Tyrosyl-DNA phosphodiesterase 1	3548.1 nM	Potency	via CMAUP

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL4793	Q86TI2	Dipeptidyl peptidase IX	94.25%	96.95%
CHEMBL4016	P42262	Glutamate receptor ionotropic, AMPA 2	94.05%	86.92%
CHEMBL4208	P20618	Proteasome component C5	91.32%	90.00%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	90.52%	94.45%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	90.03%	96.09%
CHEMBL3401	O75469	Pregnane X receptor	89.79%	94.73%
CHEMBL4657	Q6V1X1	Dipeptidyl peptidase VIII	89.28%	97.21%
CHEMBL2581	P07339	Cathepsin D	88.17%	98.95%
CHEMBL3060	Q9Y345	Glycine transporter 2	88.16%	99.17%
CHEMBL1293249	Q13887	Kruppel-like factor 5	87.84%	86.33%
CHEMBL3202	P48147	Prolyl endopeptidase	86.51%	90.65%
CHEMBL3194	P02766	Transthyretin	85.36%	90.71%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	84.77%	96.00%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	84.50%	94.00%
CHEMBL225	P28335	Serotonin 2c (5-HT2c) receptor	82.52%	89.62%
CHEMBL5339	Q5NUL3	G-protein coupled receptor 120	81.69%	95.78%
CHEMBL3492	P49721	Proteasome Macropain subunit	81.05%	90.24%

Plants that contains it

• Carapichea ipecacuanha
• Lagerstroemia indica

Cross-Links

• PubChem: 1486
• NPASS: NPC204617
• ChEMBL: CHEMBL367623
• LOTUS: LTS0105006
• wikiData: Q209222