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1-pyridin-3-ylbutan-2-one

1-pyridin-3-ylbutan-2-one structure

CAS No:
6302-10-9
Formula:
C9H11NO
Chemical Name:
1-pyridin-3-ylbutan-2-one
Synonyms:
1-(pyridin-3-yl)butan-2-one;1-pyridin-3-ylbutan-2-one;6302-10-9;NSC42765;SCHEMBL8915193;(3-pyridinyl)methyl ethyl ketone;DTXSID00285774;ZINC1675557;NSC-42765;AKOS011842961;Z2832015650

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1-pyridin-3-ylbutan-2-one Basic Attributes

Molecular Weight：

149.19 g/mol

Exact Mass：

149.084063974 g/mol

NSC Number：

42765

DSSTox ID：

DTXSID00285774

Characteristics

PSA：

30 Å²

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
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-3-ylbutan-2-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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