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CAS No.: | 49833-12-7 |
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Name: | naphtho[1,8-cd][1,2]dithiole 1-oxide |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C10H6OS2 |
Molecular Weight: | 206.289 |
Synonyms: | 1,2-DithiaacenaphtheneS-oxide;Naphthalene 1,8-disulfide-S-oxide; |
Density: | 1.59 g/cm3 |
Boiling Point: | 479.4 °C at 760 mmHg |
Flash Point: | 243.7 °C |
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The CAS register number of Naphtho[1,8-cd]-1,2-dithiole,1-oxide is 49833-12-7. It also can be called as 1,2-DithiaacenaphtheneS-oxide. The molecular formula about this chemical is C10H6OS2 and the molecular weight is 206.284.
Physical properties about Naphtho[1,8-cd]-1,2-dithiole,1-oxide are: (1)ACD/LogP: 1.98; (2)ACD/LogD (pH 5.5): 1.98; (3)ACD/LogD (pH 7.4): 1.98; (4)ACD/BCF (pH 5.5): 18.74; (5)ACD/BCF (pH 7.4): 18.74; (6)ACD/KOC (pH 5.5): 283.59; (7)ACD/KOC (pH 7.4): 283.59; (8)#H bond acceptors: 1; (9)Polar Surface Area: 61.58 Å2; (10)Index of Refraction: 1.876; (11)Molar Refractivity: 59.14 cm3; (12)Molar Volume: 129.5 cm3; (13)Polarizability: 23.44x10-24cm3; (14)Surface Tension: 93.3 dyne/cm; (15)Density: 1.59 g/cm3; (16)Flash Point: 243.7 °C; (17)Enthalpy of Vaporization: 71.53 kJ/mol; (18)Boiling Point: 479.4 °C at 760 mmHg; (19)Vapour Pressure: 6.9E-09 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S2Sc1c3c(ccc1)cccc23
(2)InChI: InChI=1/C10H6OS2/c11-13-9-6-2-4-7-3-1-5-8(12-13)10(7)9/h1-6H
(3)InChIKey: LIRFRPDBUURHNY-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C10H6OS2/c11-13-9-6-2-4-7-3-1-5-8(12-13)10(7)9/h1-6H
(5)Std. InChIKey: LIRFRPDBUURHNY-UHFFFAOYSA-N