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CAS No.: | 1731-94-8 |
---|---|
Name: | METHYL NONADECANOATE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C20H40O2 |
Molecular Weight: | 312.536 |
Synonyms: | Methylnonadecanoate; |
EINECS: | 217-056-9 |
Density: | 0.862 g/cm3 |
Melting Point: | 37-40 °C(lit.) |
Boiling Point: | 362.8 °C at 760 mmHg |
Flash Point: | 176.9 °C |
Safety: | 22-24/25 |
PSA: | 26.30000 |
LogP: | 6.81100 |
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The Nonadecanoic acid,methyl ester is an organic compound with the formula C20H40O2. The IUPAC name of this chemical is Methyl nonadecanoate. With the CAS registry number 1731-94-8, it is also named as Methylnonadecanoat. Besides, it should be stored at −20 °C.
Physical properties about Nonadecanoic acid,methyl ester are: (1)ACD/LogP: 9.21; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.21; (4)ACD/LogD (pH 7.4): 9.21; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 2438989.25; (8)ACD/KOC (pH 7.4): 2438989.25; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 18; (11)Polar Surface Area: 26.3 Å2; (12)Index of Refraction: 1.445; (13)Molar Refractivity: 96.48 cm3; (14)Molar Volume: 362.1 cm3; (15)Polarizability: 38.24×10-24 cm3; (16)Surface Tension: 30.7 dyne/cm; (17)Density: 0.862 g/cm3; (18)Flash Point: 176.9 °C; (19)Enthalpy of Vaporization: 60.88 kJ/mol; (20)Boiling Point: 362.8 °C at 760 mmHg; (21)Vapour Pressure: 1.88E-05 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
When you are using it, do not breathe dust, and avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C20H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-2/h3-19H2,1-2H3
(2)InChIKey: BDXAHSJUDUZLDU-UHFFFAOYAE
(3)Std. InChI: InChI=1S/C20H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-2/h3-19H2,1-2H3
(4)Std. InChIKey: BDXAHSJUDUZLDU-UHFFFAOYSA-N