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137918-71-9 | 2,4-Pentadienoic acid, 5-iodo-, (Z,E)-
CAS No: 137918-71-9 Catalog No: AG006YNG MDL No:
Product Description
Catalog Number:
AG006YNG
Chemical Name:
2,4-Pentadienoic acid, 5-iodo-, (Z,E)-
CAS Number:
137918-71-9
Molecular Formula:
C5H5IO2
Molecular Weight:
223.9965
IUPAC Name:
5-iodopenta-2,4-dienoic acid
InChI:
InChI=1S/C5H5IO2/c6-4-2-1-3-5(7)8/h1-4H,(H,7,8)
InChI Key:
GNAUFYNLVSWKOB-UHFFFAOYSA-N
SMILES:
I/C=C/C=C\C(=O)O
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.933g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.997g/mol
Monoisotopic Mass:
223.933g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
1.6
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