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  • Cyclanilide
Name:Cyclanilide
CAS No:113136-77-9

PRODUCT DESCRIPTION

【Name】
Cyclopropanecarboxylicacid, 1-[[(2,4-dichlorophenyl)amino]carbonyl]-
【CAS Registry number】
113136-77-9
【Synonyms】
Cyclanilide
RPA 90946
【EINECS(EC#)】
419-150-7
【Molecular Formula】
C11H9 Cl2 N O3 (Products with the same molecular formula)
【Molecular Weight】
274.1
【Inchi】
InChI=1/C11H9Cl2NO3/c12-5-1-2-9(8(13)3-5)14-10(15)6-4-7(6)11(16)17/h1-3,6-7H,4H2,(H,14,15)(H,16,17)
【Canonical SMILES】
C1C(C1C(=O)O)C(=O)NC2=C(C=C(C=C2)Cl)Cl
【MOL File】
113136-77-9.mol

Chemical and Physical Properties

【Density】
1.647 g/cm3
【Boiling Point】
513.2 °C at 760 mmHg
【Vapour】
0mmHg at 25°C
【Refractive Index】
1.687
【Flash Point】
264.2 °C
【Storage temp】
0-6°C
【Computed Properties】
Molecular Weight:274.10006 [g/mol]
Molecular Formula:C11H9Cl2NO3
XLogP3:1.8
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:3
Tautomer Count:3
Exact Mass:272.995949
MonoIsotopic Mass:272.995949
Topological Polar Surface Area:66.4
Heavy Atom Count:17
Formal Charge:0
Complexity:337
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Ring Count:1
Effective Rotor Count:4.6
Conformer Sampling RMSD:0.6
CID Conformer Count:80

Safety and Handling

【Hazard Codes】
A poison. Moderately toxic by skin contact and inhalation.
【Risk Statements】
R22
【Safety Statements 】
A poison by ingestion. Moderately toxic by skin contact and inhalation. When heated to decomposition it emits toxic vapors of NOx and Cl−.
【HazardClass】
6.1(b)
【Safety】

A poison by ingestion. Moderately toxic by skin contact and inhalation. When heated to decomposition it emits toxic vapors of NOx and Cl.
 

Hazard Codes: HarmfulXnDangerous
Risk Statements: 22-51/53 
R22:Harmful if swallowed. 
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. 
Safety Statements: 61 
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.

【PackingGroup 】
III
【Transport】
2811
【Specification】

 Cyclanilide ,its cas register number is 113136-77-9. It also can be called Cyclopropanecarboxylic acid, 1-(((2,4-dichlorophenyl)amino)carbonyl)- ; 1-[(2,4-Dichlorphenyl)carbamoyl]cyclopropancarbonsäure or Acide 1-[(2,4-dichlorophényl)carbamoyl]cyclopropanecarboxylique .

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