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Thiazafluron

Thiazafluron structure

CAS No:
25366-23-8
Formula:
C6H7F3N4OS
Chemical Name:
Thiazafluron
Synonyms:
Urea,N,N′-dimethyl-N′-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-;Urea,1,3-dimethyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-;Urea,N,N′-dimethyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-;N,N′-Dimethyl-N′-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea;N,N′-Dimethyl-N-(2-trifluoromethyl-1,3,4-thiadiazol-5-yl)urea;DMTTU;GS 29696;Erbotan;1,3-Dimethyl-3-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)urea;Thiazfluron;Thiazafluron;Thiazafluoron
Categories:
Analytical Chemistry > Standard

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Description

Thiazafluron is an organonitrogen heterocyclic compound and an organosulfur heterocyclic compound.

Thiazafluron Basic Attributes

Molecular Weight：

240.21

Exact Mass：

240.21

EC Number：

246-901-4

UNII：

WX8ID0K28Q

DSSTox ID：

DTXSID20180010

HScode：

29349990

Characteristics

PSA：

86.4

XLogP3：

1.72340

Density：

1.507g/cm3

Melting Point：

136-137 °C

Refractive Index：

1.519

Water Solubility：

2.096g/L(20 ºC)

Safety Information

Transport codes：

UN28116.1/PG3

wgk germany：

hazard class code：

22-50/53

safety instructions：

60-61

RTECS Number：

XI3760000

Marks：

Xn,N

Precautionary statement(s)：

P273-P501

Hazard Statements：

H302-H410

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 194 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

N,N-dimethyl-N'-(5-trifluromethyl-1,3,4-thiadiazol-2-yl)urea

Thiazafluron Use and Manufacturing

Use Classification：

Agrochemicals -> Herbicides

Computed Properties

Molecular Weight:240.21
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:240.02926652
Monoisotopic Mass:240.02926652
Topological Polar Surface Area:86.4
Heavy Atom Count:15
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes