Home Pyridines 10198-89-7
10198-89-7,MFCD01321157
Catalog No.:AA00063G
10198-89-7 | 1,3-Di(2-pyridyl)-1,3-propanedione
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Technical Information
Catalog Number:
AA00063G
Chemical Name:
1,3-Di(2-pyridyl)-1,3-propanedione
CAS Number:
10198-89-7
Molecular Formula:
C13H10N2O2
Molecular Weight:
226.2307
MDL Number:
MFCD01321157
IUPAC Name:
1,3-dipyridin-2-ylpropane-1,3-dione
InChI:
InChI=1S/C13H10N2O2/c16-12(10-5-1-3-7-14-10)9-13(17)11-6-2-4-8-15-11/h1-8H,9H2
InChI Key:
DCGUVLMWGIPVDP-UHFFFAOYSA-N
SMILES:
O=C(c1ccccn1)CC(=O)c1ccccn1
Properties
Computed Properties
 
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.074g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.235g/mol
Monoisotopic Mass:
226.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
10198-89-7 
1,3-Di(pyridin-2-yl)propane-1,3-dione 
SCHEMBL253276 
ACMC-1C255 
CTK3J6851 
HMS560P02 
DCGUVLMWGIPVDP-UHFFFAOYSA-N 
ANW-14566 
CCG-41518 
MFCD01321157 
SBB055662 
AKOS005203454 
Dipicolinoylmethane 
ZINC100005308 
MCULE-2289821400 
TRA0051704 
1,3-bis[2-pyridyl]-1,3-propanedione 
1,3-di-2-pyridinyl-1,3-Propanedione 
KS-000016R8 
DA-16287 
1,3-Propanedione, 1,3-di-2-pyridinyl- 
AX8053904 
RT-003311 
1,3-Di(2-pyridyl)-1,3-propanedione 
D2512 
FT-0730475 
ST24036764 
ST50950005 
Z3363 
1,3-Di(2-pyridyl)-1,3-propanedione, 97% 
SR-01000631588-1 
1,3-Di(pyridin-2-yl)propane-1,3-dione, AldrichCPR 
BRD-K39239327-001-01-8 
I14-102540 
1,3-dipyridin-2-ylpropane-1,3-dione 
4773-20-0 
C13H10N2O2 
CID2728494 
1,3-Di(2-pyridyl)-1,3-propanedione, 98% - 1G 1g 
1,3-di(2-pyridyl)propane-1,3-dione 
AK126076 
1,3-di[2-pyridyl]-1,3-propanedione 
Maybridge1_006844 
AC1MBNSX 
Literature

Title: Microwave-assisted synthesis of a ferrimagnetic dodecanuclear iron(III) complex with a Fe4(OH)4 cubane core.

Journal: Inorganic chemistry 20110321

Title: Synthesis and characterization of homo- and heterovalent tetra- hexa- hepta- and decanuclear manganese clusters using pyridyl functionalized beta-diketone, carboxylate and triethanolamine ligands.

Journal: Dalton transactions (Cambridge, England : 2003) 20100821

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