Chemical Properties of Quinoline, 6,8-dimethyl- (CAS 2436-93-3)

InChI

InChI=1S/C11H11N/c1-8-6-9(2)11-10(7-8)4-3-5-12-11/h3-7H,1-2H3

InChI Key

RLZSSWLXBLSQKI-UHFFFAOYSA-N

Formula

C11H11N

SMILES

Cc1cc(C)c2ncccc2c1

Molecular Weight¹

157.21

CAS

2436-93-3

Other Names

• 6,8-dimethylquinoline

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-3.99		Crippen Calculated Property
logPoct/wat	2.852		Crippen Calculated Property
McVol	132.610	ml/mol	McGowan Calculated Property
Inp	[1408.00; 1422.00]
Inp	1408.00		NIST
Inp	1422.00		NIST
Inp	1408.00		NIST
Inp	1422.00		NIST
I	[2013.00; 2037.00]
I	2013.00		NIST
I	2037.00		NIST
I	2013.00		NIST
I	2037.00		NIST
I	2013.00		NIST
I	2037.00		NIST
Tboil	541.70	K	NIST

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[399.82; 577.50]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.40225e+01
Coefficient B			-4.23160e+03
Coefficient C			-9.17290e+01
Temperature range, min.			399.82
Temperature range, max.			577.50
Pvap	1.33	kPa	399.82	Calculated Property
Pvap	3.05	kPa	419.56	Calculated Property
Pvap	6.35	kPa	439.30	Calculated Property
Pvap	12.21	kPa	459.05	Calculated Property
Pvap	21.97	kPa	478.79	Calculated Property
Pvap	37.35	kPa	498.53	Calculated Property
Pvap	60.45	kPa	518.27	Calculated Property
Pvap	93.76	kPa	538.02	Calculated Property
Pvap	140.10	kPa	557.76	Calculated Property
Pvap	202.63	kPa	577.50	Calculated Property

Similar Compounds

Find more compounds similar to Quinoline, 6,8-dimethyl-.

Sources

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

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