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90874-87-6 | 5-(2-pyridinyl)-2-Pentanone
CAS No: 90874-87-6 Catalog No: AG00H4OD MDL No:MFCD01605754
Product Description
Catalog Number:
AG00H4OD
Chemical Name:
5-(2-pyridinyl)-2-Pentanone
CAS Number:
90874-87-6
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD01605754
IUPAC Name:
5-pyridin-2-ylpentan-2-one
InChI:
InChI=1S/C10H13NO/c1-9(12)5-4-7-10-6-2-3-8-11-10/h2-3,6,8H,4-5,7H2,1H3
InChI Key:
JNAQSIAPRPFYPX-UHFFFAOYSA-N
SMILES:
CC(=O)CCCc1ccccn1
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:
0.8
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