Amyl 2-methylbutyrate supplier

Name
AMYL-2-METHYLBUTYRATE
EINECS 268-244-2
CAS No. 68039-26-9
Article Data2
CAS DataBase
Density 0.872 g/cm³
Solubility
Melting Point
Formula C₁₀H₂₀O₂
Boiling Point 195.7 °C at 760 mmHg
Molecular Weight 172.268
Flash Point 71.4 °C
Transport Information
Appearance Colorless liquid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Butanoic acid,2-methyl-, pentyl ester;Pentyl 2-methylbutanoate;Pentyl 2-methylbutyrate;n-Pentyl2-methylbutyrate;
PSA 26.30000
LogP 2.76590

Amyl 2-methylbutyrate Specification

The Amyl 2-methylbutyrate, with the CAS registry number 68039-26-9, is also known as Pentyl 2-methylbutanoate. Its EINECS number is 268-244-2. This chemical's molecular formula is C₁₀H₂₀O₂ and formula weight is 172.26. What's more, its IUPAC name is pentyl 2-methylbutanoate.

Physical properties of Amyl 2-methylbutyrate are: (1)ACD/LogP: 3.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.71; (4)ACD/BCF (pH 5.5): 390.38; (5)ACD/KOC (pH 5.5): 2492.26; (6)#H bond acceptors: 2; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 7; (9)Polar Surface Area: 26.3 Å²; (10)Index of Refraction: 1.421; (11)Molar Refractivity: 50.11 cm³; (12)Molar Volume: 197.4 cm³; (13)Surface Tension: 27.4 dyne/cm; (14)Density: 0.872 g/cm³; (15)Flash Point: 71.4 °C; (16)Enthalpy of Vaporization: 43.19 kJ/mol; (17)Boiling Point: 195.7 °C at 760 mmHg; (18)Vapour Pressure: 0.413 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCOC(=O)C(C)CC
(2)InChI: InChI=1S/C10H20O2/c1-4-6-7-8-12-10(11)9(3)5-2/h9H,4-8H2,1-3H3
(3)InChIKey: RHNBXPIJLXBHMF-UHFFFAOYSA-N

Product Name

AMYL-2-METHYLBUTYRATE

Amyl 2-methylbutyrate Specification

Related Products

Hot Products