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Touchdown structure

CAS No:
81591-81-3
Formula:
C3H9S.C3H7NO5P
Chemical Name:
Touchdown
Synonyms:
Glycine,N-(phosphonomethyl)-,ion(1-),trimethylsulfonium (1:1);Glycine,N-(phosphonomethyl)-,ion(1-),trimethylsulfonium;Sulfonium,trimethyl-,salt with N-(phosphonomethyl)glycine (1:1);Sulfosate;SC 0224;Touchdown;Ouragan;Avans 330;Glyphosate-trimesium;N-Phosphonomethylglycine monotrimethylsulfonium salt;Medallon;Glyphosate mono(trimethylsulfonium) salt;Trimethylsulfonium glyphosate;Glyphosate trimethylsulfonium salt;ICIA 0224;Touchdown 480;97626-33-0;99534-06-2;114416-13-6;133000-38-1;134123-46-9;87090-28-6;88426-50-0;90891-17-1;144236-63-5;152969-57-8;171667-09-7;181289-47-4
Categories:
Organic Chemistry > Phosphines

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Touchdown Basic Attributes

Molecular Weight：

245.23400

Exact Mass：

245.04900

EC Number：

617-243-9

DSSTox ID：

DTXSID5034939

Characteristics

PSA：

144.80000

XLogP3：

0.11900

Density：

1.27

Boiling Point：

465.8ºC at 760 mmHg

Flash Point：

235.5ºC

Toxicity：

LD50 in rats, mice (mg/kg): 748, 1383 orally; in rabbits (mg/kg): >2000 dermally; LC50 in rainbow trout (48 hrs): 4800 mg/l (Trouslard)

Safety Information

hazard class code：

22-51/53

safety instructions：

36/37-46-61

Marks：

Xn: Harmful;N: Dangerous for the environment;

GHS Classification：

|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, P391, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 156 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

glyphosate-trimesium

Touchdown Use and Manufacturing

Herbicide.

Computed Properties

Molecular Weight:245.24
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:245.04868078
Monoisotopic Mass:245.04868078
Topological Polar Surface Area:111
Heavy Atom Count:14
Complexity:165
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes