6-Nonenoic acid, 8-methyl-, (E)- supplier

Name
8-METHYLNON-6-ENOIC ACID
EINECS
CAS No. 59320-77-3
Article Data12
CAS DataBase
Density 0.934 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₈O₂
Boiling Point 267 °C at 760 mmHg
Molecular Weight 170.252
Flash Point 164.3 °C
Transport Information
Appearance yellow oil
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Nonenoicacid, 8-methyl-, (E)-;8-Methylnon-trans-6-enoic acid;trans-8-Methylnon-6-enoic acid;
PSA 37.30000
LogP 2.84360

6-Nonenoic acid, 8-methyl-, (E)- Specification

This chemical is called 6-Nonenoic acid, 8-methyl-, (E)-, and its systematic name is (6E)-8-methylnon-6-enoic acid. With the molecular formula of C₁₀H₁₈O₂, its molecular weight is 170.25. The CAS registry number of this chemical is 59320-77-3. Additionally, its product categories are All Aliphatics; Aliphatics.

Other characteristics of the 6-Nonenoic acid, 8-methyl-, (E)- can be summarised as followings: (1)ACD/LogP: 3.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.51; (4)ACD/LogD (pH 7.4): 0.71; (5)ACD/BCF (pH 5.5): 30.05; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 231.8; (8)ACD/KOC (pH 7.4): 3.7; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.46; (14)Molar Refractivity: 49.95 cm³; (15)Molar Volume: 182.2 cm³; (16)Polarizability: 19.8×10^-24cm³; (17)Surface Tension: 32.8 dyne/cm; (18)Density: 0.934 g/cm³; (19)Flash Point: 164.3 °C; (20)Enthalpy of Vaporization: 55.59 kJ/mol; (21)Boiling Point: 267 °C at 760 mmHg; (22)Vapour Pressure: 0.0024 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)CCCC/C=C/C(C)C
2.InChI: InChI=1/C10H18O2/c1-9(2)7-5-3-4-6-8-10(11)12/h5,7,9H,3-4,6,8H2,1-2H3,(H,11,12)/b7-5+
3.InChIKey: OCALSPDXYQHUHA-FNORWQNLBR

Product Name

8-METHYLNON-6-ENOIC ACID

6-Nonenoic acid, 8-methyl-, (E)- Specification

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