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Nicoclonate

Nicoclonate structure

CAS No:
10571-59-2
Formula:
C16H16ClNO2
Chemical Name:
Nicoclonate
Synonyms:
3-Pyridinecarboxylic acid,1-(4-chlorophenyl)-2-methylpropyl ester;Nicotinic acid,p-chloro-α-isopropylbenzyl ester;Nicoclonate;Nicoclonol

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Description

Nicoclonate is a carboxylic ester. It derives from a benzyl alcohol.

Nicoclonate Basic Attributes

Molecular Weight：

289.75700

Exact Mass：

289.76

EC Number：

234-156-8

HScode：

2933399090

Characteristics

PSA：

39.19000

XLogP3：

4.28910

Density：

1.188g/cm3

Melting Point：

61 °C

Boiling Point：

391ºC

Flash Point：

189.7ºC

Refractive Index：

1.564

Vapor Pressure：

2.72E-06mmHg at 25°C

Computed Properties

Molecular Weight:289.75
XLogP3:4.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:289.0869564
Monoisotopic Mass:289.0869564
Topological Polar Surface Area:39.2
Heavy Atom Count:20
Complexity:314
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Nicoclonate

Description
Basic Attributes
Characteristics
Computed Properties

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