Home Other Building Blocks 1-(pyridin-3-yl)butan-2-one

1-(pyridin-3-yl)butan-2-one

CAS No.:
6302-10-9
Catalog Number:
AG01BIF5
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
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Product Description
Catalog Number:
AG01BIF5
Chemical Name:
1-(pyridin-3-yl)butan-2-one
CAS Number:
6302-10-9
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD16808156
IUPAC Name:
1-pyridin-3-ylbutan-2-one
InChI:
InChI=1S/C9H11NO/c1-2-9(11)6-8-4-3-5-10-7-8/h3-5,7H,2,6H2,1H3
InChI Key:
WMTHSBOLQVKBQL-UHFFFAOYSA-N
SMILES:
CCC(=O)Cc1cccnc1
NSC Number:
42765
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties