CAS No.17061-90-4,2,4-DICHLORO-1-(2-PROPYNYLOXY)BENZENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	17061-90-4
Name:	2,4-DICHLORO-1-(2-PROPYNYLOXY)BENZENE
Article Data:	14

Formula:	C₉H₆Cl₂O
Molecular Weight:	201.052
Synonyms:	Benzene,2,4-dichloro-1-(2-propynyloxy)- (9CI);Ether, 2,4-dichlorophenyl 2-propynyl(8CI);2,4-Dichloro-1-(prop-2-ynyloxy)benzene;2,4-Dichlorophenyl 2-propynylether;2,4-Dichlorophenyl propargyl ether;3-(2,4-Dichlorophenoxy)-1-propyne;3-(2,4-Dichlorophenoxy)propyne;
Density:	1.304g/cm³
Melting Point:	47-49 °C
Boiling Point:	275.5 °C at 760 mmHg
Flash Point:	117.6 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	9.23000
LogP:	3.00540

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Specification

The Benzene,2,4-dichloro-1-(2-propyn-1-yloxy)-, with CAS registry number 17061-90-4, has the systematic name of 2,4-dichloro-1-(prop-2-yn-1-yloxy)benzene. Besides this, it is also called 3-(2,4-Dichlorophenoxy)-1-propyne. And the chemical formula of this chemical is C₉H₆Cl₂O.

Physical properties of Benzene,2,4-dichloro-1-(2-propyn-1-yloxy)-: (1)ACD/LogP: 3.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.41; (4)ACD/LogD (pH 7.4): 3.41; (5)ACD/BCF (pH 5.5): 231.89; (6)ACD/BCF (pH 7.4): 231.89; (7)ACD/KOC (pH 5.5): 1716.61; (8)ACD/KOC (pH 7.4): 1716.61; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 49.81 cm³; (15)Molar Volume: 154.1 cm³; (16)Polarizability: 19.74×10^-24cm³; (17)Surface Tension: 42.8 dyne/cm; (18)Density: 1.304 g/cm³; (19)Flash Point: 117.6 °C; (20)Enthalpy of Vaporization: 49.33 kJ/mol; (21)Boiling Point: 275.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00853 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzene,2,4-dichloro-1-(2-propyn-1-yloxy)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)ccc1OCC#C
(2)InChI: InChI=1/C9H6Cl2O/c1-2-5-12-9-4-3-7(10)6-8(9)11/h1,3-4,6H,5H2
(3)InChIKey: KEIKGHHJUQTGSZ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C9H6Cl2O/c1-2-5-12-9-4-3-7(10)6-8(9)11/h1,3-4,6H,5H2
(5)Std. InChIKey: KEIKGHHJUQTGSZ-UHFFFAOYSA-N