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88431-10-1

88431-10-1 | 2(3H)-Furanone, dihydro-5-(iodomethyl)-3-methyl-, trans-

CAS No: 88431-10-1 Catalog No: AG004HMR MDL No:

Product Description

Catalog Number:
AG004HMR
Chemical Name:
2(3H)-Furanone, dihydro-5-(iodomethyl)-3-methyl-, trans-
CAS Number:
88431-10-1
Molecular Formula:
C6H9IO2
Molecular Weight:
240.0389
IUPAC Name:
(3S,5R)-5-(iodomethyl)-3-methyloxolan-2-one
InChI:
InChI=1S/C6H9IO2/c1-4-2-5(3-7)9-6(4)8/h4-5H,2-3H2,1H3/t4-,5+/m0/s1
InChI Key:
FRFKYMPKNNZPTP-CRCLSJGQSA-N
SMILES:
C[C@H]1C[C@@H](OC1=O)CI

Properties

Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
239.965g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.04g/mol
Monoisotopic Mass:
239.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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