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3-(TRIFLUOROMETHYL)PHENYLTHIOUREA

3-(TRIFLUOROMETHYL)PHENYLTHIOUREA structure

CAS No:
1736-70-5
Formula:
C8H7F3N2S
Chemical Name:
3-(TRIFLUOROMETHYL)PHENYLTHIOUREA
Synonyms:
1-[3-(TRIFLUOROMETHYL)PHENYL]-2-THIOUREA;3-(TRIFLUOROMETHYL)PHENYLTHIOUREA;alpha,alpha,alpha-Trifluoro-m-tolylthiourea;à,à,à-trifluoro-m-tolylthiourea;1-[3-(Trifluoromethyl)phenyl]-2-thiourea 97%;1-[3-(Trifluoromethyl)phenyl]-2-thiourea97%;N-[3-(TRIFLUOROMETHYL)PHENYL]THIOUREA;3-METHYL-5-(CHLOROMETHYL)PYRIDINE HCL
Categories:
Chemical Reagents > Organic Reagents

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3-(TRIFLUOROMETHYL)PHENYLTHIOUREA Basic Attributes

Molecular Weight：

220.21

Exact Mass：

220.02800

BRN：

2695477

NSC Number：

527802

DSSTox ID：

DTXSID20352856

HScode：

2930909090

Characteristics

PSA：

70.1

XLogP3：

3.13420

Appearance：

white solid

Density：

1.457±0.06 g/cm3(Predicted)

Melting Point：

104-108 °C(lit.)

Boiling Point：

264.6±50.0 °C(Predicted)

Flash Point：

113.8ºC

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

20/22-36-43

safety instructions：

26-37/39

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P280-P305 + P351 + P338

Hazard Statements：

H302-H317-H319-H332

GHS Classification：

|Warning|H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P333+P313, P337+P313, P363, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:220.22
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:220.02820389
Monoisotopic Mass:220.02820389
Topological Polar Surface Area:70.1
Heavy Atom Count:14
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-(TRIFLUOROMETHYL)PHENYLTHIOUREA

CAS No.: 1736-70-5

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Guide of 3-(TRIFLUOROMETHYL)PHENYLTHIOUREA

Basic Attributes
Characteristics
Safety Information
Computed Properties
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3-(TRIFLUOROMETHYL)PHENYLTHIOUREA

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