2-Chloroethyl 2-methylpentanoate supplier

Name
2-Chloroethyl 2-methylpentanoate
EINECS
CAS No. 6639-13-0
Density 1.016 g/cm³
Solubility
Melting Point
Formula C₈H₁₅ClO₂
Boiling Point 223.9 °C at 760 mmHg
Molecular Weight 178.6565
Flash Point 94.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms NSC 17874;
PSA 26.30000
LogP 2.20460

2-Chloroethyl 2-methylpentanoate Specification

The 2-Chloroethyl 2-methylpentanoate, with the CAS registry number 6639-13-0, is also known as NSC 17874. This chemical's molecular formula is C₈H₁₅ClO₂ and molecular weight is 178.6565. What's more, its IUPAC name is 2-Chloroethyl 2-methylpentanoate.

Physical properties about 2-Chloroethyl 2-methylpentanoate are: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.432; (8)Molar Refractivity: 45.69 cm³; (9)Molar Volume: 175.8 cm³; (10)Polarizability: 18.11×10^-24 cm³; (11)Surface Tension: 29.8 dyne/cm; (12)Density: 1.016 g/cm³; (13)Flash Point: 94.3 °C; (14)Enthalpy of Vaporization: 46.04 kJ/mol; (15)Boiling Point: 223.9 °C at 760 mmHg; (16)Vapour Pressure: 0.094 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClCCOC(=O)C(CCC)C
(2) InChI: InChI=1/C8H15ClO2/c1-3-4-7(2)8(10)11-6-5-9/h7H,3-6H2,1-2H3
(3) InChIKey: MVTPGWUVGPCMQE-UHFFFAOYAS

Product Name

2-Chloroethyl 2-methylpentanoate

2-Chloroethyl 2-methylpentanoate Specification

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