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1,2-Cyclododecanediol

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Name

1,2-Cyclododecanediol

EINECS 239-256-5
CAS No. 15199-41-4 Density 0.968 g/cm3
PSA 40.46000 LogP 2.62280
Solubility N/A Melting Point 121.0 to 125.0 °C
Formula C12H24O2 Boiling Point 339.7 °C at 760 mmHg
Molecular Weight 200.321 Flash Point 158.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15199-41-4 (1,2-Cyclododecanediol) Hazard Symbols N/A
Synonyms

1,2-CYCLODODECANEDIOL;1,2-Cyclododecanediol (cis- and trans- mixture);Cyclododecanediol;cyclododecane-1,2-diol;cis-/trans-mixture;1,2-CYCLODODECANEDIOL (CIS+ TRANS);EINECS 239-256-5;1,2-CYCLODODECANEDIOL (CIS- AND TRANS- MIXTURE) 87+%

Article Data 10

1,2-Cyclododecanediol Specification

The 1,2-Cyclododecanediol is an organic compound with the formula C12H24O2. The IUPAC name of this chemical is Cyclododecane-1,2-diol. With the CAS registry number 15199-41-4, it is also named as cis-1,2-Cyclododecanediol. Besides, its molecular weight is 200.32.

Physical properties about 1,2-Cyclododecanediol are: (1)ACD/LogP: 3.54; (2)ACD/LogD (pH 5.5): 3.54; (3)ACD/LogD (pH 7.4): 3.54; (4)ACD/BCF (pH 5.5): 288.52; (5)ACD/BCF (pH 7.4): 288.52; (6)ACD/KOC (pH 5.5): 2007.25; (7)ACD/KOC (pH 7.4): 2007.25; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 18.46 Å2; (12)Index of Refraction: 1.477; (13)Molar Refractivity: 58.52 cm3; (14)Molar Volume: 206.8 cm3; (15)Polarizability: 23.19×10-24 cm3; (16)Surface Tension: 32.5 dyne/cm; (17)Density: 0.968 g/cm3; (18)Flash Point: 158.2 °C; (19)Enthalpy of Vaporization: 67.55 kJ/mol; (20)Boiling Point: 339.7 °C at 760 mmHg; (21)Vapour Pressure: 6.04E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C12H24O2/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11-14H,1-10H2
(2)InChIKey: HAMFVYJFVXTJCJ-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C12H24O2/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11-14H,1-10H2
(4)Std. InChIKey: HAMFVYJFVXTJCJ-UHFFFAOYSA-N

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