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54481-10-6 | 1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-propyl-3-Pyridinecarbonitrile 3-Pyridinecarbonitrile,1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-propyl-
CAS No: 54481-10-6 Catalog No: AG00DU9T MDL No:MFCD00638423
Product Description
Catalog Number:
AG00DU9T
Chemical Name:
1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-propyl-3-Pyridinecarbonitrile 3-Pyridinecarbonitrile,1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-propyl-
CAS Number:
54481-10-6
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD00638423
IUPAC Name:
2-hydroxy-4-methyl-6-oxo-1-propylpyridine-3-carbonitrile
InChI:
InChI=1S/C10H12N2O2/c1-3-4-12-9(13)5-7(2)8(6-11)10(12)14/h5,14H,3-4H2,1-2H3
InChI Key:
LPOHMYSTVUMOPY-UHFFFAOYSA-N
SMILES:
CCCn1c(O)cc(c(c1=O)C#N)C
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Synthesis of some novel biologically active disperse dyes derived from 4-methyl-2,6-dioxo-1-propyl-1,2,5,6-tetrahydro-pyridine-3-carbonitrile as coupling component and their colour assessment on polyester fabrics. | Molecules (Basel, Switzerland) 20120725 |
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