Phenol,4-(1,3-dithiolan-2-yl)-2-methoxy- supplier

Name
4-(1,3-DITHIOLAN-2-YL)-2-METHOXYPHENOL
EINECS
CAS No. 22068-62-8
Article Data11
CAS DataBase
Density 1.31 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂O₂S₂
Boiling Point 395 °C at 760 mmHg
Molecular Weight 228.336
Flash Point 192.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Hydroxy-3-methoxyphenyl)-1,3-dithiolane;
PSA 80.06000
LogP 2.87940

Phenol,4-(1,3-dithiolan-2-yl)-2-methoxy- Specification

The Phenol,4-(1,3-dithiolan-2-yl)-2-methoxy-, with the CAS registry number of 22068-62-8, is also known as 2-(4-Hydroxy-3-methoxyphenyl)-1,3-dithiolane. This chemical's molecular formula is C₁₀H₁₂O₂S₂ and molecular weight is 228.331080. What's more, its IUPAC name is 4-(1,3-Dithiolan-2-yl)-2-methoxyphenol.

Physical properties about the Phenol,4-(1,3-dithiolan-2-yl)-2-methoxy- are: (1)ACD/LogP: 2.23; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 69.06 Å²; (7)Index of Refraction: 1.644; (8)Molar Refractivity: 63.16 cm³; (9)Molar Volume: 174.2 cm³; (10)Surface Tension: 55.7 dyne/cm; (11)Density: 1.31 g/cm³; (12)Flash Point: 192.7 °C; (13)Enthalpy of Vaporization: 67.03 kJ/mol; (14)Boiling Point: 395 °C at 760 mmHg; (15)Vapour Pressure: 8.35E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: S1CCSC1c2cc(OC)c(O)cc2
(2) InChI: InChI=1/C10H12O2S2/c1-12-9-6-7(2-3-8(9)11)10-13-4-5-14-10/h2-3,6,10-11H,4-5H2,1H3
(3) InChIKey: QMTIOHSDTHZCIL-UHFFFAOYAS

Product Name

4-(1,3-DITHIOLAN-2-YL)-2-METHOXYPHENOL

Phenol,4-(1,3-dithiolan-2-yl)-2-methoxy- Specification

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