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105955-12-2

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Basic Information
CAS No.: 105955-12-2
Name: N-linoleoyldopamine
Article Data: 4
Molecular Structure:
Molecular Structure of 105955-12-2 (N-linoleoyldopamine)
Formula: C26H41NO3
Molecular Weight: 415.616
Synonyms: N-Linoleoyldopamine;
Density: 1.015 g/cm3
Boiling Point: 620.2 °C at 760 mmHg
Flash Point: 328.9 °C
PSA: 73.05000
LogP: 7.41030
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  • 9,12-Octadecadienamide,N-[2-(3,4-dihydroxyphenyl)ethyl]-, (9Z,12Z)-

  • Casno:

    105955-12-2

    9,12-Octadecadienamide,N-[2-(3,4-dihydroxyphenyl)ethyl]-, (9Z,12Z)-

    Min.Order: 10 Gram

    FOB Price:  USD $ 0.0-0.0

    Zibo Hangyu Biotechnology Development Co., Ltd is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemi

    Hangyu Biotech is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and O

  •  Zibo Hangyu Biotechnology Development Co., Ltd

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    Tel:86-15965530500

    Address:Room1701, Tianxing Building,Licheng district, jinan, Shandong, China

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Specification

The 9,12-Octadecadienamide,N-[2-(3,4-dihydroxyphenyl)ethyl]-, (9Z,12Z)-, with the CAS registry number 105955-12-2, is also known as N-Linoleoyldopamine. This chemical's molecular formula is C26H41NO3 and molecular weight is 415.61. What's more, its IUPAC name is (9Z,12Z)-N-[2-(3,4-dihydroxyphenyl)ethyl]octadeca-9,12-dienamide.

Physical properties of 9,12-Octadecadienamide,N-[2-(3,4-dihydroxyphenyl)ethyl]-, (9Z,12Z)- are: (1)ACD/LogP: 7.25; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.25; (4)ACD/LogD (pH 7.4): 7.25; (5)ACD/BCF (pH 5.5): 190409.81; (6)ACD/BCF (pH 7.4): 188985.17; (7)ACD/KOC (pH 5.5): 209298.2; (8)ACD/KOC (pH 7.4): 207732.25; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 19; (12)Polar Surface Area: 38.77 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 126.69 cm3; (15)Molar Volume: 409.3 cm3; (16)Polarizability: 50.22×10-24cm3; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.015 g/cm3; (19)Flash Point: 328.9 °C; (20)Enthalpy of Vaporization: 95.29 kJ/mol; (21)Boiling Point: 620.2 °C at 760 mmHg; (22)Vapour Pressure: 5.61E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCCc1cc(O)c(O)cc1)CCCCCCC\C=C/C\C=C/CCCCC
(2)Std. InChI: InChI=1S/C26H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(30)27-21-20-23-18-19-24(28)25(29)22-23/h6-7,9-10,18-19,22,28-29H,2-5,8,11-17,20-21H2,1H3,(H,27,30)/b7-6-,10-9-
(3)Std. InChIKey: SZYHQIGUKQSEJD-HZJYTTRNSA-N