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Name	6-Acetyl-4,4-dimethylthiochroman	EINECS	N/A
CAS No.	88579-23-1	Density	1.071g/cm³
PSA	42.37000	LogP	3.66260
Solubility	N/A	Melting Point	N/A
Formula	C13H16 O S	Boiling Point	353.8°C at 760 mmHg
Molecular Weight	220.335	Flash Point	184.618°C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	2H-1-Benzothiopyran,ethanone deriv.; 4,4-Dimethyl-6-acetylthiochroman; 6-Acetyl-4,4-dimethylthiochroman	Article Data	12

6-Acetyl-4,4-dimethylthiochroman Chemical Properties

Molecular Structure of 6-Acetyl-4,4-dimethylthiochroman (CAS No.88579-23-1):

Molecular Formula: C₁₃H₁₆OS
Molecular Weight: 220.33
CAS No: 88579-23-1
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 42.37 Å²
Index of Refraction: 1.554
Molar Refractivity: 65.939 cm³
Molar Volume: 205.685 cm³
Surface Tension: 39.996 dyne/cm
Density: 1.071 g/cm³
Flash Point: 184.618 °C
Enthalpy of Vaporization: 59.877 kJ/mol
Boiling Point: 353.8 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
InChI: InChI=1/C₁₃H₁₆OS/c1-9(14)10-4-5-12-11(8-10)13(2,3)6-7-15-12/h4-5,8H,6-7H2,1-3H3
InChIKey: DHIVJYNSSSHXRG-UHFFFAOYAP
Std. InChI: InChI=1S/C₁₃H₁₆OS/c1-9(14)10-4-5-12-11(8-10)13(2,3)6-7-15-12/h4-5,8H,6-7H2,1-3H3
Std. InChIKey: DHIVJYNSSSHXRG-UHFFFAOYSA-N
Systematic Name: 1-(4,4-Dimethyl-3,4-dihydro-2H-thiochromen-6-yl)ethanone

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