Pentadecane, 1-bromo- supplier

Name
1-BROMOPENTADECANE
EINECS 211-104-2
CAS No. 629-72-1
Article Data35
CAS DataBase
Density 1.006 g/cm³
Solubility Not miscible in water.
Melting Point 17-19 °C(lit.)
Formula C₁₅H₃₁Br
Boiling Point 321.9 °C at 760 mmHg
Molecular Weight 291.315
Flash Point 133.7 °C
Transport Information
Appearance Clear clrless to pale yellow liquid after melting
Safety 23-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Bromopentadecane;NSC 133440;Pentadecyl bromide;n-Pentadecyl bromide;
PSA 0.00000
LogP 6.47250

Pentadecane, 1-bromo- Specification

The Pentadecane, 1-bromo-, with CAS registry number 629-72-1, belongs to the following product categories: (1)Alkyl Bromides; (2)Monofunctional & alpha,omega-Bifunctional Alkanes; (3)Monofunctional Alkanes. It has the systematic name of 1-bromopentadecane. This chemical is a kind of clear clrless to pale yellow liquid after melting. When use it, do not breathe vapour and avoid contact with skin and eyes.

Physical properties of Pentadecane, 1-bromo-: (1)ACD/LogP: 8.59; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.59; (4)ACD/LogD (pH 7.4): 8.59; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 1117665.13; (8)ACD/KOC (pH 7.4): 1117665.13; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.46; (14)Molar Refractivity: 79.27 cm³; (15)Molar Volume: 289.3 cm³; (16)Polarizability: 31.42×10^-24cm³; (17)Surface Tension: 30.7 dyne/cm; (18)Density: 1.006 g/cm³; (19)Flash Point: 133.7 °C; (20)Enthalpy of Vaporization: 54.13 kJ/mol; (21)Boiling Point: 321.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000544 mmHg at 25°C.

Preparation: this chemical can be prepared by hexadecanoic acid. This reaction will need reagents bromine, red mercuric oxide.

Pentadecane, 1-bromo- can be prepared by hexadecanoic acid

You can still convert the following datas into molecular structure:
(1)SMILES: BrCCCCCCCCCCCCCCC
(2)InChI: InChI=1/C15H31Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h2-15H2,1H3
(3)InChIKey: JKOTZBXSNOGCIF-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C15H31Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h2-15H2,1H3
(5)Std. InChIKey: JKOTZBXSNOGCIF-UHFFFAOYSA-N

Product Name

1-BROMOPENTADECANE

Pentadecane, 1-bromo- Specification

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