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106335-92-6 | 5-Hexyn-1-ol, 6-iodo-
CAS No: 106335-92-6 Catalog No: AG007D06 MDL No:
Product Description
Catalog Number:
AG007D06
Chemical Name:
5-Hexyn-1-ol, 6-iodo-
CAS Number:
106335-92-6
Molecular Formula:
C6H9IO
Molecular Weight:
224.0395
IUPAC Name:
6-iodohex-5-yn-1-ol
InChI:
InChI=1S/C6H9IO/c7-5-3-1-2-4-6-8/h8H,1-2,4,6H2
InChI Key:
MNEUMBNKHDDMOG-UHFFFAOYSA-N
SMILES:
OCCCCC#CI
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.97g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.041g/mol
Monoisotopic Mass:
223.97g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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