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1570-48-5 | 1-(Pyridin-3-yl)propan-1-one
CAS No: 1570-48-5 Catalog No: AG003JW3 MDL No:MFCD00023589
Product Description
Catalog Number:
AG003JW3
Chemical Name:
1-(Pyridin-3-yl)propan-1-one
CAS Number:
1570-48-5
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD00023589
IUPAC Name:
1-pyridin-3-ylpropan-1-one
InChI:
InChI=1S/C8H9NO/c1-2-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3
InChI Key:
VDNKJMUNLKAGAM-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cccnc1
EC Number:
216-380-8
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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