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76225-97-3 | 2-iodopropanedial
CAS No: 76225-97-3 Catalog No: AG01B6XA MDL No:MFCD12923234
Product Description
Catalog Number:
AG01B6XA
Chemical Name:
2-iodopropanedial
CAS Number:
76225-97-3
Molecular Formula:
C3H3IO2
Molecular Weight:
197.9592
MDL Number:
MFCD12923234
IUPAC Name:
2-iodopropanedial
InChI:
InChI=1S/C3H3IO2/c4-3(1-5)2-6/h1-3H
InChI Key:
CTDBHYCWOSCODO-UHFFFAOYSA-N
SMILES:
O=CC(C=O)I
Properties
Complexity:
53.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.918g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.959g/mol
Monoisotopic Mass:
197.918g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| Reaction routes leading to CO2 and CO in the Briggs-Rauscher oscillator: analogies between the oscillatory BR and BZ reactions. | The journal of physical chemistry. A 20090813 |
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