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88631-69-0 | Pyridine, 5-(2-furanylmethylene)-2,3,4,5-tetrahydro-
CAS No: 88631-69-0 Catalog No: AG0049UP MDL No:
Product Description
Catalog Number:
AG0049UP
Chemical Name:
Pyridine, 5-(2-furanylmethylene)-2,3,4,5-tetrahydro-
CAS Number:
88631-69-0
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
5-(furan-2-ylmethylidene)-3,4-dihydro-2H-pyridine
InChI:
InChI=1S/C10H11NO/c1-3-9(8-11-5-1)7-10-4-2-6-12-10/h2,4,6-8H,1,3,5H2
InChI Key:
UPWWMTDOYNHLQR-UHFFFAOYSA-N
SMILES:
C1CCC(=Cc2ccco2)C=N1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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