Octadecanoic acid,17-methyl- supplier

Name
17-METHYLOCTADECANOIC ACID
EINECS
CAS No. 2724-59-6
Article Data10
CAS DataBase
Density 0.885 g/cm³
Solubility
Melting Point 67.5°C
Formula C₁₉H₃₈O₂
Boiling Point 415.3 °C at 760 mmHg
Molecular Weight 298.51
Flash Point 234.5 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 17-Methyloctadecanoicacid;17-Methylstearic acid;
PSA 37.30000
LogP 6.57850

Octadecanoic acid,17-methyl- Specification

The Octadecanoic acid,17-methyl- is an organic compound with the formula C₁₉H₃₈O₂. The IUPAC name of this chemical is 17-methyloctadecanoic acid. With the CAS registry number 2724-59-6, it is also named as 17-Methylstearic acid.

Physical properties about Octadecanoic acid,17-methyl- are: (1)ACD/LogP: 8.56; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.77; (4)ACD/LogD (pH 7.4): 5.97; (5)ACD/BCF (pH 5.5): 303528.97; (6)ACD/BCF (pH 7.4): 4869.37; (7)ACD/KOC (pH 5.5): 173564.14; (8)ACD/KOC (pH 7.4): 2784.4; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.455; (14)Molar Refractivity: 91.59 cm³; (15)Molar Volume: 337.1 cm³; (16)Polarizability: 36.31×10^-24cm³; (17)Surface Tension: 32.8 dyne/cm; (18)Density: 0.885 g/cm³; (19)Flash Point: 234.5 °C; (20)Enthalpy of Vaporization: 73.32 kJ/mol; (21)Boiling Point: 415.3 °C at 760 mmHg; (22)Vapour Pressure: 4.64E-08 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES:O=C(O)CCCCCCCCCCCCCCCC(C)C
(2)InChI: InChI=1/C19H38O2/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(20)21/h18H,3-17H2,1-2H3,(H,20,21)
(3)InChIKey: YETXGSGCWODRAA-UHFFFAOYAR

Product Name

17-METHYLOCTADECANOIC ACID

Octadecanoic acid,17-methyl- Specification

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