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168295-35-0 | 2,4-Pentadienal, 5-iodo-, (2E,4E)-
CAS No: 168295-35-0 Catalog No: AG001XZX MDL No:
Product Description
Catalog Number:
AG001XZX
Chemical Name:
2,4-Pentadienal, 5-iodo-, (2E,4E)-
CAS Number:
168295-35-0
Molecular Formula:
C5H5IO
Molecular Weight:
207.9971
IUPAC Name:
5-iodopenta-2,4-dienal
InChI:
InChI=1S/C5H5IO/c6-4-2-1-3-5-7/h1-5H
InChI Key:
BOIFHZPYWVJCKZ-UHFFFAOYSA-N
SMILES:
I/C=C/C=C/C=O
Properties
Complexity:
94.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.939g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.998g/mol
Monoisotopic Mass:
207.939g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
1.5
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