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99643-42-2

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Basic Information
CAS No.: 99643-42-2
Name: 2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin
Molecular Structure:
Molecular Structure of 99643-42-2 (2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin)
Formula: C21H12S4
Molecular Weight: 392.58
Density: 1.56 g/cm3
Boiling Point: 680.1 °C at 760 mmHg
Flash Point: 548.4 °C
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  • 2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin

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    99643-42-2

    2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin

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    Our company engages in Electronic chemicals such as OLED，Photoresist chemical，Electrolyte additive and Intermediate Pharmaceutical production; development of noble metal catalysts,

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  • 2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin

  • Casno:

    99643-42-2

    2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin

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    Our own factory produces direct sales with absolute price advantage Application:Pharmaceutical industry Transportation:By sea Port:Shanghai/tianjin

    Antimex Chemical Limied, was founded in 2001, we are specializing in manufacturing & researching of Active pharmaceutical Ingredients,Veterinary pharm APIs,cosmetic ingredients,and

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  • 2,2'-spirobi<naphthol<1,8-de>-1,3-dithiin>

  • Casno:

    99643-42-2

    2,2'-spirobi-1,3-dithiin>

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    Mature technology, stable product Package:10g.100g.1kg.10kg Application:Biological agents, pharmaceutical intermediates Transportation:Seal freeze-dried preservation

    Hangzhou yi lu biological technology Co., LTD. was founded in 2011, which is a high-tech company specializing in customized chemical synthesis and R&D of pharmaceutical intermediat

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Specification

The 2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin is an organic compound with the formula C21H12S4. With the CAS registry number 99643-42-2, the systematic name of this chemical is 2,2'-spirobi[naphtho[1,8-de][1,3]dithiine].

Physical properties about 2,2-Spirobi(naphtho(1,8-de)-1,3-dithiin are: (1)ACD/LogP: 7.33; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.33; (4)ACD/LogD (pH 7.4): 7.33; (5)ACD/BCF (pH 5.5): 217355.25; (6)ACD/BCF (pH 7.4): 217355.25; (7)ACD/KOC (pH 5.5): 230102.73; (8)ACD/KOC (pH 7.4): 230102.73; (9)Polar Surface Area: 101.2 Å2; (10)Index of Refraction: 1.924; (11)Molar Refractivity: 119.17 cm3; (12)Molar Volume: 251.3 cm3; (13)Polarizability: 47.24×10-24cm3; (14)Surface Tension: 88.3 dyne/cm; (15)Density: 1.56 g/cm3; (16)Flash Point: 548.4 °C; (17)Enthalpy of Vaporization: 96.2 kJ/mol; (18)Boiling Point: 680.1 °C at 760 mmHg; (19)Vapour Pressure: 1.39E-17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: S1c6cccc5cccc(SC13Sc2c4c(ccc2)cccc4S3)c56
(2)InChI: InChI=1/C21H12S4/c1-5-13-6-2-10-16-19(13)15(9-1)22-21(23-16)24-17-11-3-7-14-8-4-12-18(25-21)20(14)17/h1-12H
(3)InChIKey: DFCDCJLVMMPUSC-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C21H12S4/c1-5-13-6-2-10-16-19(13)15(9-1)22-21(23-16)24-17-11-3-7-14-8-4-12-18(25-21)20(14)17/h1-12H
(5)Std. InChIKey: DFCDCJLVMMPUSC-UHFFFAOYSA-N