2H-Thiopyran-3-carboxylicacid, tetrahydro- supplier

Name
2H-Thiopyran-3-carboxylicacid,tetrahydro-(9CI)
EINECS 200-589-5
CAS No. 161404-76-8
Density 1.237 g/cm³
Solubility
Melting Point 111.5-112.5℃
Formula C₆H₁₀O₂S
Boiling Point 301.8 °C at 760 mmHg
Molecular Weight 146.21
Flash Point 136.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2H-Thiopyran-3-carboxylicacid,tetrahydro-(9CI);2H-Thiopyran-3-carboxylicacid,tetrahydro;Tetrahydro-2H-thiopyran-3-carboxylic acid
PSA 62.60000
LogP 1.21420

2H-Thiopyran-3-carboxylicacid, tetrahydro- Specification

The 2H-Thiopyran-3-carboxylicacid, tetrahydro- has CAS registry number 161404-76-8. It belongs to the product category of Carboxylic acid. Its molecular formula is C₆H₁₀O₂S and molecular weight is 146.209. What's more, its systematic name is Tetrahydro-2H-thiopyran-3-carboxylic acid.

Physical properties about the 2H-Thiopyran-3-carboxylicacid, tetrahydro- are: (1)ACD/LogP: 0.85; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 4.23; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 62.6 Å²; (11)Index of Refraction: 1.544; (12)Molar Refractivity: 37.32 cm³; (13)Molar Volume: 118.1 cm³; (14)Surface Tension: 49.3 dyne/cm; (15)Density: 1.237 g/cm³; (16)Flash Point: 136.3 °C; (17)Enthalpy of Vaporization: 59.61 kJ/mol; (18)Boiling Point: 301.8 °C at 760 mmHg; (19)Vapour Pressure: 0.000241 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC(=O)C1CSCCC1
(2) InChI: InChI=1/C6H10O2S/c7-6(8)5-2-1-3-9-4-5/h5H,1-4H2,(H,7,8)
(3) InChIKey: DCMOTEAFHXHTAL-UHFFFAOYAZ

Product Name

2H-Thiopyran-3-carboxylicacid,tetrahydro-(9CI)

2H-Thiopyran-3-carboxylicacid, tetrahydro- Specification

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