Grass kills

grass kills structural formula

grass kills structural formula

Structural formula

Business number 028L
Molecular formula C8H14ClNS2
Molecular weight 223.79
label

Grass kills, Caicao special,

Thioallate,Vegedex,

herbicide

Numbering system

CAS number:95-06-7

MDL number:MFCD00048530

EINECS number:202-388-9

RTECS number:EZ5075000

BRN number:1772271

PubChem number:24869212

Physical property data

None

Toxicological data

1. Acute toxicity: rat oral LD50: 850mg/kg; rabbit skin contact LD50: 2200mg/kg;

2. Chronic toxicity/carcinogenicity

Large Rat oral TDLo: 6825mg/kg/78W-C; mouse oral TDLo: 59mg/kg/78W-C; rat oral TD: 11mg/kg/78W-I; mouse oral TD: 120mg/kg /78W-I;

1. Mutagenicity

Mutation of Salmonella typhimurium: 10μL/plate;

Mutation of Salmonella typhimurium: 10μg/plate ;

Microbial mutation: 1100μg/plate;

Aspergillus nidulans mutation: 20μL/plate;

DNA inhibition of human lymphocytes: 500mg/L;

DNA inhibition of rat cells: 1mg/L;

Ecological data

None

Molecular structure data

1. Molar refractive index: 62.53

2. Molar volume (cm3/mol): 193.0

3. Isotonic specific volume (90.2K ): 496.9

4. Surface tension (dyne/cm): 43.8

5. Polarizability (10-24cm3): 24.79

Compute chemical data

1. Hydrophobic parameter calculation reference value (XlogP): 3.1

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 0

4. Number of rotatable chemical bonds: 5

5. Number of tautomers:

6. Topological molecular polar surface area (TPSA): 3.2

7. Number of heavy atoms: 12

8. Surface charge: 0

9. Complexity: 166

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters Number: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None

Storage method

None

Synthesis method

None

Purpose

None

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