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93040-51-8 | 2(3H)-Furanone, dihydro-5-(iodomethylene)-, (E)-
CAS No: 93040-51-8 Catalog No: AG006J5S MDL No:
Product Description
Catalog Number:
AG006J5S
Chemical Name:
2(3H)-Furanone, dihydro-5-(iodomethylene)-, (E)-
CAS Number:
93040-51-8
Molecular Formula:
C5H5IO2
Molecular Weight:
223.9965
IUPAC Name:
5-(iodomethylidene)oxolan-2-one
InChI:
InChI=1S/C5H5IO2/c6-3-4-1-2-5(7)8-4/h3H,1-2H2
InChI Key:
XIPQQPOTDOENIA-UHFFFAOYSA-N
SMILES:
I/C=C/1\CCC(=O)O1
Properties
Complexity:
139
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:
0
Isotope Atom Count:
0
Molecular Weight:
223.997g/mol
Monoisotopic Mass:
223.933g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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