Chemical Properties of Neocinchophen (CAS 485-34-7)

InChI

InChI=1S/C19H17NO2/c1-3-22-19(21)16-12-18(14-7-5-4-6-8-14)20-17-10-9-13(2)11-15(16)17/h4-12H,3H2,1-2H3

InChI Key

BUDBHJPMAKXMLD-UHFFFAOYSA-N

Formula

C19H17NO2

SMILES

CCOC(=O)c1cc(-c2ccccc2)nc2ccc(C)cc12

Molecular Weight¹

291.34

CAS

485-34-7

Other Names

4-Quinolinecarboxylic acid, 6-methyl-2-phenyl-, ethyl ester
Cinchoninic acid, 6-methyl-2-phenyl-, ethyl ester
Ethyl 2-phenyl-6-methylcinchoninate
Ethyl 6-methyl-2-phenyl-4-quinolinecarboxylate
Ethyl 6-methyl-2-phenylcinchoninate
Neoatophan
Neocincophen
Neomagnephen
Neophan
Neoquinophan
Neu-Nylofanol
Novatophan
Novo-rheumatophin
Tolysin
6-Methyl-2-phenylquinoline-4-carboxylic acid, ethyl ester
6-Methylcinchophen, ethyl ester

log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
McVol : McGowan's characteristic volume (ml/mol).
I_np : Non-polar retention indices.
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
log₁₀WS	-6.78		Crippen Calculated Property
logP_oct/wat	4.387		Crippen Calculated Property
McVol	229.010	ml/mol	McGowan Calculated Property
I_np	[2495.00; 2495.00]
I_np	2495.00		NIST
I_np	2495.00		NIST

Similar Compounds

Find more compounds similar to Neocinchophen.

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