Chemical Properties of 3-Hexylthiophene (CAS 1693-86-3)

InChI

InChI=1S/C10H16S/c1-2-3-4-5-6-10-7-8-11-9-10/h7-9H,2-6H2,1H3

InChI Key

JEDHEMYZURJGRQ-UHFFFAOYSA-N

Formula

C10H16S

SMILES

CCCCCCc1ccsc1

Molecular Weight¹

168.30

CAS

1693-86-3

• 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_vap : Vapor pressure (kPa).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.67]	kPa	[378.32; 523.32]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.56026e+01
Coefficient B			-4.54880e+03
Coefficient C			-8.13040e+01
Temperature range, min.			378.32
Temperature range, max.			523.32
Pvap	1.33	kPa	378.32	Calculated Property
Pvap	2.93	kPa	394.43	Calculated Property
Pvap	5.97	kPa	410.54	Calculated Property
Pvap	11.37	kPa	426.65	Calculated Property
Pvap	20.45	kPa	442.76	Calculated Property
Pvap	34.99	kPa	458.88	Calculated Property
Pvap	57.29	kPa	474.99	Calculated Property
Pvap	90.23	kPa	491.10	Calculated Property
Pvap	137.32	kPa	507.21	Calculated Property
Pvap	202.67	kPa	523.32	Calculated Property

Similar Compounds

Find more compounds similar to 3-Hexylthiophene.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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