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3-Quinolinecarboxylicacid,2-methyl-6-nitro-4-phenyl-,ethylester

3-Quinolinecarboxylicacid,2-methyl-6-nitro-4-phenyl-,ethylester structure

CAS No:
627073-30-7
Formula:
C19H16N2O4
Chemical Name:
3-Quinolinecarboxylicacid,2-methyl-6-nitro-4-phenyl-,ethylester
Synonyms:
3-Quinolinecarboxylic acid, 2-methyl-6-nitro-4-phenyl-, ethyl ester;Ethyl 2-methyl-6-nitro-4-phenylquinoline-3-carboxylate

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3-Quinolinecarboxylicacid,2-methyl-6-nitro-4-phenyl-,ethylester Basic Attributes

Molecular Weight：

336.34

Exact Mass：

336.11100700 g/mol

DSSTox ID：

DTXSID10359495

Characteristics

PSA：

85 Å²

Density：

1.271±0.06 g/cm3

Melting Point：

139-142 °C(Solv: ethanol (64-17-5))

Boiling Point：

481.7±45.0 °C(Predicted)

PKA：

2.41±0.50

Computed Properties

Molecular Weight:336.3
XLogP3:4.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:336.11100700
Monoisotopic Mass:336.11100700
Topological Polar Surface Area:85
Heavy Atom Count:25
Complexity:486
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Quinolinecarboxylicacid,2-methyl-6-nitro-4-phenyl-,ethylester

Basic Attributes
Characteristics
Computed Properties

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