4-Pentenoic acid, 2-acetyl-4-methyl-, ethyl ester supplier

Name
4-Pentenoicacid,2-acetyl-4-methyl-,ethyl
EINECS
CAS No. 20962-70-3
Article Data28
CAS DataBase
Density 0.972 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₆O₃
Boiling Point 231 °C at 760 mmHg
Molecular Weight 184.235
Flash Point 91.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethyl2-acetyl-4-methyl-4-pentenoate;Ethyl 2-methallylacetoacetate;NSC 29893;
PSA 43.37000
LogP 1.72090

4-Pentenoic acid, 2-acetyl-4-methyl-, ethyl ester Specification

This chemical is called 4-Pentenoicacid, 2-acetyl-4-methyl-,ethyl, and it can also be named as NSC 29893. With the molecular formula of C₁₀H₁₆O₃, its molecular weight is 184.23. The CAS registry number of this chemical is 20962-70-3.

Other characteristics of the (Trimethylsilyl)acetic acid can be summarised as followings: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.45; (4)ACD/LogD (pH 7.4): 2.45; (5)ACD/BCF (pH 5.5): 43.1; (6)ACD/BCF (pH 7.4): 43.09; (7)ACD/KOC (pH 5.5): 514.69; (8)ACD/KOC (pH 7.4): 514.64; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 43.37 Å²; (13)Index of Refraction: 1.437; (14)Molar Refractivity: 49.7 cm³; (15)Molar Volume: 189.4 cm³; (16)Polarizability: 19.7×10^-24cm³; (17)Surface Tension: 29.7 dyne/cm; (18)Density: 0.972 g/cm³; (19)Flash Point: 91.8 °C; (20)Enthalpy of Vaporization: 46.77 kJ/mol; (21)Boiling Point: 231 °C at 760 mmHg; (22)Vapour Pressure: 0.0638 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(C(C(=O)OCC)C\C(=C)C)C
2.InChI: InChI=1/C10H16O3/c1-5-13-10(12)9(8(4)11)6-7(2)3/h9H,2,5-6H2,1,3-4H3
3.InChIKey: DVIFNSDZOSQUGX-UHFFFAOYAG

Product Name

4-Pentenoicacid,2-acetyl-4-methyl-,ethyl

4-Pentenoic acid, 2-acetyl-4-methyl-, ethyl ester Specification

Related Products

Hot Products