Sodium 2,4-dichlorophenoxyacetate

The Sodium-2,4-dichlorophenoxyacetate, with the CAS registry number 2702-72-9, is also known as 2,4-Dichlorophenoxyacetic acid sodium salt. It belongs to the product categories of Pharmaceutical Raw Materials;Auxins; Biochemistry; Plant Growth Regulators. Its EINECS registry number is 220-290-4. Its systematic name is called sodium (2,4-dichlorophenoxy)acetate. This chemical's classification codes are Agricultural Chemical; Herbicide; Human Data; Mutation data; Reproductive Effect. It is clear brown to black liquid. The product should be sealed and stored in cool and dry place. In addition, this chemical can be used as agricultural herbicides and plant growth regulators.

Physical properties of Sodium-2,4-dichlorophenoxyacetate: (1)ACD/LogP: 2.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Flash Point: 162.8 °C; (13)Melting Point: 215°C; (14)Enthalpy of Vaporization: 62.24 kJ/mol; (15)Boiling Point: 345.6 °C at 760 mmHg; (16)Vapour Pressure: 2.31E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical that may cause damage to health and may present an immediate or delayed danger to one or more components of the environment. It is harmful if swallowed. There will be a risk of serious damage to eyes when concat it. This chemical may cause sensitisation by skin contact. It is toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. Avoid contact with skin and eyes. You should avoid contact with skin and eyes. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. If swallowed, you should seek medical advice immediately and show this container or label. In addition, you should avoid releasing it to the environment. When use it, please refer to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].Clc1cc(Cl)ccc1OCC([O-])=O
(2)InChI: InChI=1/C8H6Cl2O3.Na/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;/h1-3H,4H2,(H,11,12);/q;+1/p-1
(3)InChIKey: RFOHRSIAXQACDB-REWHXWOFAE

The toxicity data is as follows: