CAS No.13360-61-7,1-Pentadecene Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	13360-61-7
Name:	1-Pentadecene
Article Data:	51

Formula:	C₁₅H₃₀
Molecular Weight:	210.403
Synonyms:	NSC 77125;Pentadecene,1-;
EINECS:	236-414-5
Density:	0.775 g/cm³
Melting Point:	-4 °C
Boiling Point:	268.7 °C at 760 mmHg
Flash Point:	116.7 °C
Appearance:	CLEAR COLORLESS TO LIGHT YELLOW LIQUID
Safety:	23-24/25
PSA:	0.00000
LogP:	5.87350

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Specification

The 1-Pentadecene, with the CAS registry number 13360-61-7, is also known as Pentadecene,1-. Its EINECS number is 236-414-5. It belongs to the product categories of 1-Olefins (GC Standard); Analytical Chemistry; Standard Materials for GC; Acyclic; Alkenes; Organic Building Blocks; Alpha Sort; Chemical Class; Hydrocarbons; Neats Gasoline, Diesel, &Petroleum; Olefins Volatiles/ Semivolatiles; P; PA - PEN; P-SAlphabetic; Substance classes. This chemical's molecular formula is C₁₅H₃₀ and molecular weight is 210.40. What's more, its systematic name is Pentadec-1-ene. Its storage temperature is 2-8 °C

Physical properties of 1-Pentadecene are: (1)ACD/LogP: 8.22; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.22; (4)ACD/LogD (pH 7.4): 8.22; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 702016.5; (8)ACD/KOC (pH 7.4): 702016.5; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.438; (14)Molar Refractivity: 71.26 cm³; (15)Molar Volume: 271.2 cm³; (16)Polarizability: 28.25×10^-24 cm³; (17)Surface Tension: 26.9 dyne/cm; (18)Density: 0.775 g/cm³; (19)Flash Point: 116.7 °C; (20)Enthalpy of Vaporization: 48.64 kJ/mol; (21)Boiling Point: 268.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0125 mmHg at 25 °C.

Preparation: this chemical can be prepared by (prop-2-ene-1-sulfonyl)-benzene and tridodecylaluminium at 50 °C. This reaction will need reagents Li2CuCl₄, PPh₃ and solvent octane with the reaction time of 5 hours. The yield is about 66%.

Uses of 1-Pentadecene: it can be used to produce pentadecane at the ambient temperature. It will need reagent H₂ and solvent H₂O with the reaction time of 60 hours. This reaction will also need catalyst Rhodium chloride tri(triphenylphosphine-meta-trisulfonate). The yield is about 95%.

When you are using this chemical, please be cautious about it as the following:
Do not breathe gas/fumes/vapour/spray of it, and it must be avoided contacting with skin and eyes.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCCC=C
(2)InChI: InChI=1S/C15H30/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3H,1,4-15H2,2H3
(3)InChIKey: PJLHTVIBELQURV-UHFFFAOYSA-N