Dodecane, 2-chloro- supplier

Name
2-chlorododecane
EINECS 219-081-0
CAS No. 2350-11-0
Article Data13
CAS DataBase
Density 0.859g/cm³
Solubility
Melting Point -9.3°C (estimate)
Formula C₁₂H₂₅Cl
Boiling Point 256.2 °C at 760 mmHg
Molecular Weight 204.784
Flash Point 99.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Chlorododecane;
PSA 0.00000
LogP 5.14450

Dodecane, 2-chloro- Specification

The Dodecane, 2-chloro-, with CAS registry number 2350-11-0, has the systematic name of 2-chlorododecane. And its IUPAC name is the same one. Its molecular weight is 204.7799. It has other registry number of 51191-26-5. And the chemical formula of this chemical is C₁₂H₂₅Cl. What's more, its EINECS is 219-081-0.

Physical properties of Dodecane, 2-chloro-: (1)ACD/LogP: 6.63; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.63; (4)ACD/LogD (pH 7.4): 6.63; (5)ACD/BCF (pH 5.5): 64395.29; (6)ACD/BCF (pH 7.4): 64395.29; (7)ACD/KOC (pH 5.5): 96329.41; (8)ACD/KOC (pH 7.4): 96329.41; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.436; (14)Molar Refractivity: 62.45 cm³; (15)Molar Volume: 238.3 cm³; (16)Polarizability: 24.75×10^-24cm³; (17)Surface Tension: 27.4 dyne/cm; (18)Density: 0.859 g/cm³; (19)Flash Point: 99.5 °C; (20)Enthalpy of Vaporization: 47.38 kJ/mol; (21)Boiling Point: 256.2 °C at 760 mmHg; (22)Vapour Pressure: 0.025 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(CCCCCCCCCC)C
(2)InChI: InChI=1/C12H25Cl/c1-3-4-5-6-7-8-9-10-11-12(2)13/h12H,3-11H2,1-2H3
(3)InChIKey: IRQJPTVOWBXCHM-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C12H25Cl/c1-3-4-5-6-7-8-9-10-11-12(2)13/h12H,3-11H2,1-2H3
(5)Std. InChIKey: IRQJPTVOWBXCHM-UHFFFAOYSA-N

Product Name

2-chlorododecane

Dodecane, 2-chloro- Specification

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