Benzene,(2-propyn-1-yloxy)- supplier

Name
PHENYL PROPARGYL ETHER
EINECS 237-095-5
CAS No. 13610-02-1
Article Data139
CAS DataBase
Density 1.014 g/cm³
Solubility Slightly soluble in water (1.0 g/L at 25°C).
Melting Point 273℃ (decomposition)
Formula C₉H₈O
Boiling Point 202.7 °C at 760 mmHg
Molecular Weight 132.162
Flash Point 68.6 °C
Transport Information
Appearance Clear colorless to faintly yellow liquid
Safety 26-39
Risk Codes 37/38-41
Molecular Structure
Hazard Symbols Xi
Synonyms Benzene,(2-propynyloxy)- (9CI);Ether, phenyl 2-propynyl (6CI,7CI,8CI);(2-Propynyloxy)benzene;(Phenoxymethyl)acetylene;(Propargyloxy)benzene;1-Phenoxy-2-propyne;3-Phenoxy-1-propyne;3-Phenoxypropyne;Phenyl 2-propynylether;Phenyl propargyl ether;Propargyl phenyl ether;
PSA 9.23000
LogP 1.69860

Benzene,(2-propyn-1-yloxy)- Specification

The Benzene,(2-propyn-1-yloxy)-, with the CAS registry number 13610-02-1, is also known as Phenyl 2-propynyl ether. Its EINECS number is 237-095-5. This chemical's molecular formula is C₉H₈O and molecular weight is 132.16. What's more, its IUPAC name is Prop-2-ynoxybenzene. It is stable at room temperature and pressure, and It should be sealed and stored in a cool and dry place and be protected from strong oxidizes.

Physical properties of Benzene,(2-propyn-1-yloxy)- are: (1)ACD/LogP: 2.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.17; (4)ACD/LogD (pH 7.4): 2.17; (5)ACD/BCF (pH 5.5): 26.3; (6)ACD/BCF (pH 7.4): 26.3; (7)ACD/KOC (pH 5.5): 361.44; (8)ACD/KOC (pH 7.4): 361.44; (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: 1.526; (14)Molar Refractivity: 40.02 cm³; (15)Molar Volume: 130.2 cm³; (16)Polarizability: 15.86×10^-24 cm³; (17)Surface Tension: 37.6 dyne/cm; (18)Density: 1.014 g/cm³; (19)Flash Point: 68.6 °C; (20)Enthalpy of Vaporization: 42.1 kJ/mol; (21)Boiling Point: 202.7 °C at 760 mmHg; (22)Vapour Pressure: 0.41 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. It has risk of serious damage to eyes. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C#CCOC1=CC=CC=C1
(2)InChI: InChI=1S/C9H8O/c1-2-8-10-9-6-4-3-5-7-9/h1,3-7H,8H2
(3)InChIKey: AIQRJSXKXVZCJO-UHFFFAOYSA-N

Product Name

PHENYL PROPARGYL ETHER

Benzene,(2-propyn-1-yloxy)- Specification

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