Chemical Properties of Quinoline, 5-methyl- (CAS 7661-55-4)

InChI

InChI=1S/C10H9N/c1-8-4-2-6-10-9(8)5-3-7-11-10/h2-7H,1H3

InChI Key

LMYVCXSKCQSIEQ-UHFFFAOYSA-N

Formula

C10H9N

SMILES

Cc1cccc2ncccc12

Molecular Weight¹

143.19

CAS

7661-55-4

Other Names

• 5-Methylquinoline

• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-3.52		Crippen Calculated Property
logPoct/wat	2.543		Crippen Calculated Property
McVol	118.520	ml/mol	McGowan Calculated Property
Inp	[1307.00; 1355.00]
Inp	1355.00		NIST
Inp	1355.00		NIST
Inp	1307.00		NIST
I	[2025.00; 2054.00]
I	2025.00		NIST
I	2054.00		NIST
I	2025.00		NIST
I	2054.00		NIST
I	2025.00		NIST
I	2054.00		NIST
Tboil	531.00 ± 2.00	K	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[393.02; 565.64]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.41490e+01
Coefficient B			-4.20908e+03
Coefficient C			-8.93660e+01
Temperature range, min.			393.02
Temperature range, max.			565.64
Pvap	1.33	kPa	393.02	Calculated Property
Pvap	3.04	kPa	412.20	Calculated Property
Pvap	6.31	kPa	431.38	Calculated Property
Pvap	12.13	kPa	450.56	Calculated Property
Pvap	21.83	kPa	469.74	Calculated Property
Pvap	37.14	kPa	488.92	Calculated Property
Pvap	60.17	kPa	508.10	Calculated Property
Pvap	93.44	kPa	527.28	Calculated Property
Pvap	139.86	kPa	546.46	Calculated Property
Pvap	202.65	kPa	565.64	Calculated Property

Similar Compounds

Find more compounds similar to Quinoline, 5-methyl-.

Sources

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

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.