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Name |
Hexadecanoic acid,2-hydroxy- |
EINECS | 212-129-1 |
CAS No. | 764-67-0 | Density | 0.955 g/cm3 |
PSA | 57.53000 | LogP | 4.52310 |
Solubility | N/A | Melting Point |
86 °C |
Formula | C16H32O3 | Boiling Point | 405.5 °C at 760 mmHg |
Molecular Weight | 272.428 | Flash Point | 213.2 °C |
Transport Information | N/A | Appearance | White powder |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
5S-Hydroxy-hexadecanoic acid;14S-Hydroxy-hexadecanoic acid; |
Article Data | 28 |
The Hexadecanoic acid,2-hydroxy-, with the CAS registry number 764-67-0, is also known as 5S-Hydroxy-hexadecanoic acid and 14S-Hydroxy-hexadecanoic acid. It belongs to the product category of Fatty & Aliphatic Acids, Esters, Alcohols & Derivatives. Its EINECS registry number is 212-129-1. This chemical's molecular formula is C16H32O3 and molecular weight is 272.42. What's more, both its IUPAC name and systematic name are the same which is called 2-Hydroxyhexadecanoic acid.
Physical properties about this chemical are: (1)ACD/LogP: 6.21; (2)#of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.1; (4)ACD/LogD (pH 7.4): 2.65; (5)ACD/BCF (pH 5.5): 241.57; (6)ACD/BCF (pH 7.4): 8.48; (7)ACD/KOC (pH 5.5): 445.51; (8)ACD/KOC (pH 7.4): 15.63; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.467; (14)Molar Refractivity: 79.23 cm3; (15)Molar Volume: 285.1 cm3; (16)Surface Tension: 37.2 dyne/cm; (17)Density: 0.955 g/cm3; (18)Flash Point: 213.2 °C; (19)Enthalpy of Vaporization: 75.94 kJ/mol; (20)Boiling Point: 405.5 °C at 760 mmHg; (21)Vapour Pressure: 2.89E-08 mmHg at 25 °C; (22)Melting Point: 86 °C.
Uses of Hexadecanoic acid,2-hydroxy-: it is used to produce other chemicals. For example, it is used to produce Pentadecanal.
The reaction occurs with reagents Lead (IV)-acetate, Glacial acetic acid at temperature of 60-70 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C(O)CCCCCCCCCCCCCC
(2) InChI: InChI=1/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
(3) InChIKey: JGHSBPIZNUXPLA-UHFFFAOYAI