Ethyl 8-bromooctanoate supplier

Name
8-BROMOOCTANOIC ACID ETHYL ESTER
EINECS 608-417-5
CAS No. 29823-21-0
Article Data1
CAS DataBase
Density 1.194 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₉BrO₂
Boiling Point 267.1 °C at 760 mmHg
Molecular Weight 251.164
Flash Point 139.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Caprylicacid, h-bromo-, ethyl ester (4CI);8-Bromocaprylic acid ethyl ester;8-caprylic acid ethyl ester;NSC 100182;Ethyl w-bromooctanoate;Ethyl omega-bromooctanoate;;
PSA 26.30000
LogP 3.28500

Ethyl 8-bromooctanoate Specification

The Ethyl 8-bromooctanoate with cas registry number of 29823-21-0, is also named Caprylicacid, h-bromo-, ethyl ester (4CI) ; 8-Bromocaprylic acid ethyl ester .

Physical properties of Ethyl 8-bromooctanoate :(1)ACD/LogP: 3.76; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 9; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.462; (8)Molar Refractivity: 57.88 cm³; (9)Molar Volume: 210.2 cm³; (10)Polarizability: 22.94×10^-24cm³; (11)Surface Tension: 33.7 dyne/cm; (12)Enthalpy of Vaporization: 50.51 kJ/mol; (13)Vapour Pressure: 0.00831 mmHg at 25°C .

You can still convert the following datas into molecular structure: (1)SMILES:BrCCCCCCCC(=O)OCC; (2)InChI:InChI=1/C10H19BrO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h2-9H2,1H3; (3)InChIKey:UBTQVPMVWAEGAC-UHFFFAOYAI; (4)Std. InChI:InChI=1S/C10H19BrO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h2-9H2,1H3; (5)Std. InChIKey:UBTQVPMVWAEGAC-UHFFFAOYSA-N.

Product Name

8-BROMOOCTANOIC ACID ETHYL ESTER

Ethyl 8-bromooctanoate Specification

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