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1-pyridin-2-ylbutan-1-one

1-pyridin-2-ylbutan-1-one structure

CAS No:
22971-32-0
Formula:
C9H11NO
Chemical Name:
1-pyridin-2-ylbutan-1-one
Synonyms:
(pyridinyl-2)-1 butanone-1; 2-BUTYRYLPYRIDINE; 1-[2]Pyridyl-butan-1-on; 1-(2-Pyridinyl)-1-butanone; 1-pyridin-2-yl-butan-1-one; 5-(Diethylamino)-2-Furaldehyde; 1-(2-pyridyl)butan-1-one; 2-butanoylpyridine; 1-Butanone,1-(2-pyridyl); 1-(Pyridin-2-yl)butan-1-one;Expand

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1-pyridin-2-ylbutan-1-one Basic Attributes

Molecular Weight：

149.19000

Exact Mass：

149.084063974 g/mol

DSSTox ID：

DTXSID60339464

HScode：

2933399090

Characteristics

PSA：

29.96000

XLogP3：

2.06440

Density：

1.013g/cm3

Boiling Point：

230.4ºC at 760 mmHg

Flash Point：

98.6ºC

Refractive Index：

1.504

Vapor Pressure：

0.0661mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:149.19
XLogP3:1.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:149.084063974
Monoisotopic Mass:149.084063974
Topological Polar Surface Area:30
Heavy Atom Count:11
Complexity:134
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-pyridin-2-ylbutan-1-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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