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89754-05-2 | 2,4-Pentadienoic acid, 5-(2-furanyloxy)-, ethyl ester
CAS No: 89754-05-2 Catalog No: AG0040B6 MDL No:
Product Description
Catalog Number:
AG0040B6
Chemical Name:
2,4-Pentadienoic acid, 5-(2-furanyloxy)-, ethyl ester
CAS Number:
89754-05-2
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
IUPAC Name:
ethyl 5-(furan-2-yloxy)penta-2,4-dienoate
InChI:
InChI=1S/C11H12O4/c1-2-13-10(12)6-3-4-8-14-11-7-5-9-15-11/h3-9H,2H2,1H3
InChI Key:
AABAZMGENJBQGF-UHFFFAOYSA-N
SMILES:
CCOC(=O)C=CC=COc1ccco1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.3
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