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3,5-Dichlorobenzoic acid

CAS No.
51-36-5
Chemical Name:
3,5-Dichlorobenzoic acid
Synonyms
3,5-dichlorobenzoic;3.5-Dichlorobe;BUTTPARK 45\07-34;RARECHEM AL BO 0040;3,5-DICHLOROBENZIC ACID;3,5-dichloro-benzoicaci;3,5-Dichlorbenzoesaeure;3,5-DICHLOROBENZOIC ACID;BENZOIC ACID, 3,5-DICHLORO-;3,5-Dichlorobenzoicacid,99%
CBNumber:
CB3760057
Molecular Formula:
C7H4Cl2O2
Molecular Weight:
191.01
MDL Number:
MFCD00002494
MOL File:
51-36-5.mol
Last updated:2023-06-29 17:43:46

3,5-Dichlorobenzoic acid Properties

Melting point 184-187 °C (lit.)
Boiling point 273.68°C (rough estimate)
Density 1.4410 (rough estimate)
refractive index 1.4590 (estimate)
storage temp. Sealed in dry,Room Temperature
form powder to crystal
pka 3.46±0.10(Predicted)
color White to Almost white
Water Solubility 147.1mg/L(temperature not stated)
BRN 2044776
InChI InChI=1S/C7H4Cl2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
InChIKey CXKCZFDUOYMOOP-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC(Cl)=CC(Cl)=C1
CAS DataBase Reference 51-36-5(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 7BAA7R70GN
NIST Chemistry Reference 3,5-Dichlorobenzoic acid(51-36-5)
EPA Substance Registry System 3,5-Dichlorobenzoic acid (51-36-5)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-37/39
WGK Germany  3
RTECS  DG7350000
HazardClass  IRRITANT
HS Code  29163990
Toxicity mouse,LD50,intraperitoneal,237mg/kg (237mg/kg),BEHAVIORAL: REGIDITYBEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY),Journal of Medicinal Chemistry. Vol. 11, Pg. 1020, 1968.
NFPA 704
0
2 0

3,5-Dichlorobenzoic acid price More Price(40)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich D57507 3,5-Dichlorobenzoic acid 97% 51-36-5 25g $70.8 2024-03-01 Buy
TCI Chemical D0341 3,5-Dichlorobenzoic Acid >98.0%(T) 51-36-5 25g $25 2024-03-01 Buy
TCI Chemical D0341 3,5-Dichlorobenzoic Acid >98.0%(T) 51-36-5 500g $370 2024-03-01 Buy
Alfa Aesar A15168 3,5-Dichlorobenzoic acid, 99% 51-36-5 5g $36.65 2024-03-01 Buy
Alfa Aesar A15168 3,5-Dichlorobenzoic acid, 99% 51-36-5 25g $126.65 2024-03-01 Buy
Product number Packaging Price Buy
D57507 25g $70.8 Buy
D0341 25g $25 Buy
D0341 500g $370 Buy
A15168 5g $36.65 Buy
A15168 25g $126.65 Buy

3,5-Dichlorobenzoic acid Chemical Properties,Uses,Production

Chemical Properties

White to beige powder

Uses

3,5-Dichlorobenzoic acid is used in organic synthesis and pesticide and pharmaceutical intermediates. It can be used to synthesize 3,5-Dichloro-N-(4-hydroxyphenethyl)benzamide and (3,5-Dichlorophenyl)-(4-fluorophenyl)methanone.

Definition

ChEBI: 3,5-dichlorobenzoic acid is a chlorobenzoic acid that is benzoic acid in which the ring hydrogens at positions 3 and 5 are substituted by chloro groups. It has a role as a herbicide and a metabolite. It is a chlorobenzoic acid and a dichlorobenzene. It derives from a benzoic acid. It is a conjugate acid of a 3,5-dichlorobenzoate.

Preparation

Synthesis of 3,5-dichlorobenzoic acid: 200 parts of ethanol is slowly added to a solution, heated to 70°C, of the diazonium salt prepared as described in Example 1 from 412 parts of 3,5-dichloroanthranilic acid; elimination of nitrogen immediately takes place with evolution of heat. The mixture is stirred for another 15 minutes and 350 parts (92% of theory) of 3,5-dichlorobenzoic acid having a melting point of 176° to 178°C is isolated as described in Example 1.

Synthesis Reference(s)

Journal of the American Chemical Society, 73, p. 455, 1951 DOI: 10.1021/ja01145a145

Purification Methods

Crystallise the acid from EtOH and sublime it in a vacuum. [Beilstein 9 IV 1008.] Aromatic acid impurities (to <0.05%) can be removed via the (±)--methylbenzylamine salt as described for 2,4-dichlorobenzoic acid [Ley & Yates Organic Process Research & Development 12 120 2008.]

6575-00-4
51-36-5
Synthesis of 3,5-Dichlorobenzoic acid from 3,5-Dichlorobenzonitrile
Global( 412)Suppliers
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View Lastest Price from 3,5-Dichlorobenzoic acid manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
3,5-Dichlorobenzoic acid pictures 2024-04-24 3,5-Dichlorobenzoic acid
51-36-5
US $20.00 / KG 1KG 99% 300MT/year Speranza Chemical Co., Ltd.
3,5-Dichlorobenzoic acid pictures 2024-01-08 3,5-Dichlorobenzoic acid
51-36-5
US $16.00-10.00 / kg 1kg 99.50% 10kg Wuhan Boyuan Import & Export Co., LTD
3,5-Dichlorobenzoic acid pictures 2023-04-21 3,5-Dichlorobenzoic acid
51-36-5
US $59.00-35.00 / kg 1kg 99 20 BTC pharm India
BENZOIC ACID, 3,5-DICHLORO- BUTTPARK 45\07-34 RARECHEM AL BO 0040 3.5-Dichlorobe 3, 5-Dichlorobenzoic acid, MTBE 3,5-Dichlorobenzoic Acid Standard 3,5-Dichlorobenzoic Acid, 97+% 3,5-DICHLOROBENZOIC ACID 3,5-dichlorobenzoic acid solution 3,5-DICHLOROBENZIC ACID BIS(TRICHORO METHYL)CARBONATE 3,5-dichloro-benzoicaci 3,5-DICHLOROBENZOIC ACID, 1X1ML,MTBE 100 0UG/ML 3,5-DICHLOROBENZOIC ACID, 1GM, NEAT 3,5-Dichlorobenzoicacid,99% 3,5-Dichlorobenzoic acid Solution, 100ppm 3,5-Dichlorobenzoic Acid @100 μg/mL in MeOH 3,5-Dichlorobenzoic Acid > 3,5-Dichlorobenzoic Acid @1000 μg/mL in MeOH 3,5-Dichlorobenzoic acid @100 μg/mL in AcCN 3,5- Dichlorobenzoic acid (DBA) 3,5-Dichlorbenzoesaeure 3,5-dichlorobenzoic 3,5-Pyrole Dicarboxalic acid 51-36-5 Organic Building Blocks Carbonyl Compounds Carboxylic Acids C7 Building Blocks Building Blocks Carbonyl Compounds Carboxylic Acids Chemical Synthesis Organic Building Blocks FINE Chemical & INTERMEDIATES Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts Organic acids Alpha sort D DAlphabetic DIA - DIC Pesticides&Metabolites C7 Carbonyl Compounds Carboxylic Acids 500 Series Drinking Water Methods DIA - DICEPA Method 552 Volatiles/ Semivolatiles bc0001