Chemical Properties of 1,2-Dithiin, 3,4-dihydro-4-methyl-3-(1-propenyl)- (CAS 60051-36-7)

InChI

InChI=1S/C8H12S2/c1-3-4-8-7(2)5-6-9-10-8/h3-8H,1-2H3/b4-3+

InChI Key

GKMUSNHMVCWOHG-ONEGZZNKSA-N

Formula

C8H12S2

SMILES

CC=CC1SSC=CC1C

Molecular Weight¹

172.31

CAS

60051-36-7

Other Names

• 4-Methyl-3-propenyl-3,4-dihydro-[1,2]dithiine

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	223.12	kJ/mol	Joback Calculated Property
ΔfH°gas	91.05	kJ/mol	Joback Calculated Property
ΔfusH°	18.12	kJ/mol	Joback Calculated Property
ΔvapH°	45.40	kJ/mol	Joback Calculated Property
log10WS	-3.90		Crippen Calculated Property
logPoct/wat	3.476		Crippen Calculated Property
McVol	136.820	ml/mol	McGowan Calculated Property
Pc	3310.55	kPa	Joback Calculated Property
Inp	[1332.00; 1344.00]
Inp	1332.00		NIST
Inp	1344.00		NIST
Inp	1332.00		NIST
Tboil	496.30	K	Joback Calculated Property
Tc	741.38	K	Joback Calculated Property
Tfus	345.64	K	Joback Calculated Property
Vc	0.473	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[278.26; 360.07]	J/mol×K	[496.30; 741.38]
Cp,gas	278.26	J/mol×K	496.30	Joback Calculated Property
Cp,gas	294.45	J/mol×K	537.15	Joback Calculated Property
Cp,gas	309.55	J/mol×K	577.99	Joback Calculated Property
Cp,gas	323.60	J/mol×K	618.84	Joback Calculated Property
Cp,gas	336.67	J/mol×K	659.69	Joback Calculated Property
Cp,gas	348.81	J/mol×K	700.53	Joback Calculated Property
Cp,gas	360.07	J/mol×K	741.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Dithiin, 3,4-dihydro-4-methyl-3-(1-propenyl)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.