4-Chlorophenylacetic acid

4-Chlorophenylacetic acid Basic information
Product Name:4-Chlorophenylacetic acid
Synonyms:P-Chlorophenylacetic acid (4-Chlorophenylacetic acid);4-Chlorophenylacetic acid, 98% 100GR;4-Chlorophenylacetic acid, 98% 5GR;NSC 14285;4-chloroacetate;4-Chlorophenylacetic acid ReagentPlus(R), 99%;4-Chlorophenylacetic Acid, 97+%;4-Chlorophenylacetic acid Vetec(TM) reagent grade, 98%
CAS:1878-66-6
MF:C8H7ClO2
MW:170.59
EINECS:217-521-6
Product Categories:C8;Carbonyl Compounds;Carboxylic Acids;Phenylacetic acid;Organic acids;FINE Chemical & INTERMEDIATES;Aromatic Phenylacetic Acids and Derivatives;Phenylacetic acid series
Mol File:1878-66-6.mol
4-Chlorophenylacetic acid Structure
4-Chlorophenylacetic acid Chemical Properties
Melting point 102-105 °C(lit.)
Boiling point 241.44°C (rough estimate)
density 1.2315 (rough estimate)
refractive index 1.5660 (estimate)
storage temp. Sealed in dry,Room Temperature
solubility ethanol: soluble100mg/mL, clear, faintly yellow
form Powder
pka4.19(at 25℃)
color White to cream
PH2.5-3 (100g/l, H2O, 20℃)suspension
BRN 1072816
InChIInChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKeyCDPKJZJVTHSESZ-UHFFFAOYSA-N
SMILESC1(CC(O)=O)=CC=C(Cl)C=C1
CAS DataBase Reference1878-66-6(CAS DataBase Reference)
NIST Chemistry ReferenceAcetic acid, p-chlorophenyl-(1878-66-6)
EPA Substance Registry Systemp-Chlorophenylacetic acid (1878-66-6)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 20/21-36/37/38
Safety Statements 36/37-24/25-36-26
WGK Germany 3
RTECS AG0590000
13
TSCA Yes
HS Code 29163900
Toxicitymouse,LD50,intraperitoneal,1350mg/kg (1350mg/kg),Farmaco, Edizione Scientifica. Vol. 13, Pg. 286, 1958.
MSDS Information
ProviderLanguage
PCPA English
SigmaAldrich English
ACROS English
ALFA English
4-Chlorophenylacetic acid Usage And Synthesis
Chemical Propertieswhite to cream colored powder
Uses4-Chlorophenylacetic acid was used to study the mechanism of aerobic degradation of 1,1-dichloro-2,2-bis(4-chlorophenyl)ethane by Ralstonia eutropha A5.
Uses4-Chlorophenylacetic Acid is a chlorinated phenyl acetic acid that is an antitumor differentiation inducer and may be an effective therapeutic agent in neuroblastoma therapy. 4-Chlorophenylacetic Acid shows plant growth-regulating activity.
Uses4-Chlorophenylacetic Acid is a chlorinated phenyl acetic acid that is an antitumor differentiation inducer and may be an effective therapeutic agent in neuroblastoma therapy. 4-Chlorophenylacetic Acid shows plant growth-regulating activity.
DefinitionChEBI: A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 4-chlorophenyl group.
General Description4-Chlorophenylacetic acid possess anticancer properties. It is a novel therapeutic agent which can be useful in prevention or treatment of estrogen-sensitive breast cancer. It acts as carbon and energy supplement and is degraded by Pseudomonas sp. strain CBS3.
Purification MethodsPurify it as for 3-chlorophenylacetic acid. [Beilstein 9 III 2263, 9 IV 1674.]
4-Chlorophenylacetic acid Preparation Products And Raw materials
Preparation ProductsFenvalerate-->Esfenvalerate-->brofenvalerate-->6-Chloro-2-tetralone-->VALERATE-->4-Chlorophenethylalcohol-->4-Biphenylacetic acid-->4-Chlorobenzyl chloride-->2-(4-CHLOROPHENYL)INDANE-1,3-DIONE-->4-CARBOXYPHENYLACETIC ACID-->2-(4-Chlorophenyl)-N-Methylacetamide-->4-chloro-alpha-oxo-Benzenepropanenitrile-->5-(4-CHLOROPHENYL)-2-PYRIMIDINETHIOL-->3-Pyrrolidinecarboxylic acid, 3-(4-chlorophenyl)-, methyl ester
-Chlorophenylacetic acid ethyl ester 3-AMINO-4-CHLOROPHENYLACETIC ACID Ethyl 2-(Chlorosulfonyl)acetate Ascoric Acid 4,4'-DDA 4-CHLORO-3-NITROPHENYLACETIC ACID 2-FLUORO-4-CHLOROPHENYLACETIC ACID 3-AMINO-4-CHLOROPHENYLACETIC ACID METHYL ESTER ALPHA-CHLOROPHENYLACETIC ACID CHLORIDE 2-BROMO-6-CHLOROPHENYLACETIC ACID Methyl 2,4-dichlorophenylacetate (+/-)-ALPHA-AMINO-2-CHLOROPHENYLACETIC ACID A-CHLOROPHENYLACETIC ACID 10MG [R] α-Bromo-p-chlorophenylacetic acid p-Dichlorobenzene à-bromo-2-chlorophenylacetic acid,ɑ-Bromo-2-chlorophenylacetic acid, 98%,A-BROMO 2-CHLOROPHENYLACETIC ACID alpha-Amino-o-chlorophenylacetic acid, 2-(2-Chlorophenyl)glycine,(+/-)-ALPHA-AMINO-2-CHLOROPHENYLACETIC ACID m-Chlorophenylacetic acid methyl ester

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