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89753-97-9 | 2,4,6,8-Nonatetraenal, 9-(2-furanyloxy)-
CAS No: 89753-97-9 Catalog No: AG0040U4 MDL No:
Product Description
Catalog Number:
AG0040U4
Chemical Name:
2,4,6,8-Nonatetraenal, 9-(2-furanyloxy)-
CAS Number:
89753-97-9
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
IUPAC Name:
9-(furan-2-yloxy)nona-2,4,6,8-tetraenal
InChI:
InChI=1S/C13H12O3/c14-10-6-4-2-1-3-5-7-11-15-13-9-8-12-16-13/h1-12H
InChI Key:
WXLPWOWUPVUAOO-UHFFFAOYSA-N
SMILES:
O=CC=CC=CC=CC=COc1ccco1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.236g/mol
Monoisotopic Mass:
216.079g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
4
XLogP3:
2.8
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