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90874-88-7 | 5-(pyridin-3-yl)pentan-2-one
CAS No: 90874-88-7 Catalog No: AG01C1NJ MDL No:MFCD16301089
Product Description
Catalog Number:
AG01C1NJ
Chemical Name:
5-(pyridin-3-yl)pentan-2-one
CAS Number:
90874-88-7
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD16301089
IUPAC Name:
5-pyridin-3-ylpentan-2-one
InChI:
InChI=1S/C10H13NO/c1-9(12)4-2-5-10-6-3-7-11-8-10/h3,6-8H,2,4-5H2,1H3
InChI Key:
DRNYVXCVAMTSMI-UHFFFAOYSA-N
SMILES:
CC(=O)CCCc1cccnc1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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