CAS No.57981-61-0,(Z,E)-trideca-4,7-dien-1-ol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	57981-61-0
Name:	(Z,E)-trideca-4,7-dien-1-ol
Article Data:	18

Formula:	C₁₃H₂₄O
Molecular Weight:	196.333
Synonyms:	4,7-Tridecadien-1-ol,(Z,E)-;(Z,E)-Trideca-4,7-dien-1-ol;
EINECS:	261-059-8
Density:	0.861 g/cm³
Boiling Point:	295.1 °C at 760 mmHg
Flash Point:	109.3 °C
PSA:	20.23000
LogP:	3.84170

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Specification

The 4,7-Tridecadien-1-ol,(4E,7Z)-, with the CAS registry number 57981-61-0, is also known as (Z,E)-Trideca-4,7-dien-1-ol. Its EINECS registry number is 261-059-8. This chemical's molecular formula is C₁₃H₂₄O and molecular weight is 196.33. What's more, both its IUPAC name and systematic name are the same which is called (4E,7Z)-Trideca-4,7-dien-1-ol.

Physical properties about 4,7-Tridecadien-1-ol,(4E,7Z)- are: (1)ACD/LogP: 4.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.74; (4)ACD/LogD (pH 7.4): 4.74; (5)ACD/BCF (pH 5.5): 2364.67; (6)ACD/BCF (pH 7.4): 2364.67; (7)ACD/KOC (pH 5.5): 9047.76; (8)ACD/KOC (pH 7.4): 9047.76; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.473; (14)Molar Refractivity: 63.92 cm³; (15)Molar Volume: 227.8 cm³; (16)Surface Tension: 31.6 dyne/cm; (17)Density: 0.861 g/cm³; (18)Flash Point: 109.3 °C; (19)Enthalpy of Vaporization: 62.04 kJ/mol; (20)Boiling Point: 295.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000163 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCCC/C=C/C\C=C/CCCCC
(2) InChI: InChI=1S/C13H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h6-7,9-10,14H,2-5,8,11-13H2,1H3/b7-6-,10-9+
(3) InChIKey: RJYCGBIUZZJVLQ-IXWMQOLASA-N