9-Heptadecanol supplier | CasNO.624-08-8

Name
9-Heptadecanol
EINECS
CAS No. 624-08-8
Article Data30
CAS DataBase
Density 0.835 g/cm³
Solubility
Melting Point 58.0 to 62.0 °C
Formula C₁₇H₃₆O
Boiling Point 318.2 °C at 760 mmHg
Molecular Weight 256.472
Flash Point 122 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 9-HEPTADECANOL;NISTC624088;Heptadecan-9-ol
PSA 20.23000
LogP 5.84850

9-Heptadecanol Specification

The 9-Heptadecanol is an organic compound with the formula C₁₇H₃₆O. With the CAS registry number 624-08-8, the IUPAC name of this chemical is heptadecan-9-ol.

Physical properties about 9-Heptadecanol are: (1)ACD/LogP: 7.60; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.6; (4)ACD/LogD (pH 7.4): 7.6; (5)ACD/BCF (pH 5.5): 350824.72; (6)ACD/BCF (pH 7.4): 350824.72; (7)ACD/KOC (pH 5.5): 324152.13; (8)ACD/KOC (pH 7.4): 324152.13; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.448; (14)Molar Refractivity: 82.3 cm³; (15)Molar Volume: 307 cm³; (16)Polarizability: 32.62×10^-24cm³; (17)Surface Tension: 30.6 dyne/cm; (18)Density: 0.835 g/cm³; (19)Flash Point: 122 °C; (20)Enthalpy of Vaporization: 64.88 kJ/mol; (21)Boiling Point: 318.2 °C at 760 mmHg; (22)Vapour Pressure: 3.05E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(CCCCCCCC)CCCCCCCC
(2)InChI: InChI=1/C17H36O/c1-3-5-7-9-11-13-15-17(18)16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3
(3)InChIKey: WTWWTKPAEZQYPW-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C17H36O/c1-3-5-7-9-11-13-15-17(18)16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3
(5)Std. InChIKey: WTWWTKPAEZQYPW-UHFFFAOYSA-N

Product Name

9-Heptadecanol

9-Heptadecanol Specification

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