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Home > Pyridines > 919095-46-8
919095-46-8 | 1-(2-furanyl)-3-(2-pyridinyl)-1,3-Propanedione
CAS No: 919095-46-8 Catalog No: AG00H52T MDL No:MFCD11178632
Product Description
Catalog Number:
AG00H52T
Chemical Name:
1-(2-furanyl)-3-(2-pyridinyl)-1,3-Propanedione
CAS Number:
919095-46-8
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD11178632
IUPAC Name:
1-(furan-2-yl)-3-pyridin-2-ylpropane-1,3-dione
InChI:
InChI=1S/C12H9NO3/c14-10(9-4-1-2-6-13-9)8-11(15)12-5-3-7-16-12/h1-7H,8H2
InChI Key:
UOPXXVAHYNKLAA-UHFFFAOYSA-N
SMILES:
O=C(c1ccccn1)CC(=O)c1ccco1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.058g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.208g/mol
Monoisotopic Mass:
215.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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