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134832-35-2 | 2-Hexen-4-yn-1-ol, 6,6-diethoxy-2-iodo-, (Z)-
CAS No: 134832-35-2 Catalog No: AG00703O MDL No:
Product Description
Catalog Number:
AG00703O
Chemical Name:
2-Hexen-4-yn-1-ol, 6,6-diethoxy-2-iodo-, (Z)-
CAS Number:
134832-35-2
Molecular Formula:
C10H15IO3
Molecular Weight:
310.1288
IUPAC Name:
6,6-diethoxy-2-iodohex-2-en-4-yn-1-ol
InChI:
InChI=1S/C10H15IO3/c1-3-13-10(14-4-2)7-5-6-9(11)8-12/h6,10,12H,3-4,8H2,1-2H3
InChI Key:
MNQAMJDPVQYTBF-UHFFFAOYSA-N
SMILES:
CCOC(C#C/C=C(/CO)\I)OCC
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.007g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
310.131g/mol
Monoisotopic Mass:
310.007g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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