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1-Phenyl-2-(4-pyridinyl)ethanone

1-Phenyl-2-(4-pyridinyl)ethanone structure

CAS No:
1620-55-9
Formula:
C13H11NO
Chemical Name:
1-Phenyl-2-(4-pyridinyl)ethanone
Synonyms:
Ethanone,1-phenyl-2-(4-pyridinyl)-;Acetophenone,2-(4-pyridyl)-;1-Phenyl-2-(4-pyridinyl)ethanone;4-Phenacylpyridine;Phenyl 4-pyridylmethyl ketone;2-(4-Pyridyl)acetophenone;NSC 146504;1-Phenyl-2-(4-pyridyl)ethanone;1-Phenyl-2-(pyridin-4-yl)ethanone;1-Phenyl-2-(pyridin-4-yl)ethan-1-one

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1-Phenyl-2-(4-pyridinyl)ethanone Basic Attributes

Molecular Weight：

197.23300

Exact Mass：

197.23

NSC Number：

146504

DSSTox ID：

DTXSID10301813

HScode：

2933399090

Characteristics

PSA：

29.96000

XLogP3：

2.50700

Density：

1.127g/cm3

Melting Point：

100-105 °C

Boiling Point：

353ºC

Flash Point：

173.5ºC

Refractive Index：

1.588

Vapor Pressure：

4.44E-05mmHg at 25°C

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:197.23
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:197.084063974
Monoisotopic Mass:197.084063974
Topological Polar Surface Area:30
Heavy Atom Count:15
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Phenyl-2-(4-pyridinyl)ethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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