Chemical Properties of Quinoline, 2,3-dimethyl- (CAS 1721-89-7)

InChI

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

InChI Key

FBOFHVFMPNNIKN-UHFFFAOYSA-N

Formula

C11H11N

SMILES

Cc1cc2ccccc2nc1C

Molecular Weight¹

157.21

CAS

1721-89-7

Other Names

• 2,3-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.
• 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	[1427.00; 1443.00]
Inp	1427.00		NIST
Inp	1443.00		NIST
Inp	1427.00		NIST
Inp	1443.00		NIST
Inp	1427.00		NIST
I	[2066.00; 2090.00]
I	2066.00		NIST
I	2090.00		NIST
I	2066.00		NIST
I	2090.00		NIST
I	2066.00		NIST
I	2090.00		NIST
I	2066.00		NIST
I	2090.00		NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[395.42; 576.95]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.37587e+01
Coefficient B			-4.11164e+03
Coefficient C			-9.02000e+01
Temperature range, min.			395.42
Temperature range, max.			576.95
Pvap	1.33	kPa	395.42	Calculated Property
Pvap	3.07	kPa	415.59	Calculated Property
Pvap	6.42	kPa	435.76	Calculated Property
Pvap	12.38	kPa	455.93	Calculated Property
Pvap	22.29	kPa	476.10	Calculated Property
Pvap	37.83	kPa	496.27	Calculated Property
Pvap	61.09	kPa	516.44	Calculated Property
Pvap	94.46	kPa	536.61	Calculated Property
Pvap	140.66	kPa	556.78	Calculated Property
Pvap	202.66	kPa	576.95	Calculated Property

Similar Compounds

Find more compounds similar to Quinoline, 2,3-dimethyl-.

Sources

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

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