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305805-94-1 | 4-Penten-2-ol, 4-iodo-5-phenoxy-, (4Z)-
CAS No: 305805-94-1 Catalog No: AG0030KU MDL No:
Product Description
Catalog Number:
AG0030KU
Chemical Name:
4-Penten-2-ol, 4-iodo-5-phenoxy-, (4Z)-
CAS Number:
305805-94-1
Molecular Formula:
C11H13IO2
Molecular Weight:
304.1242
IUPAC Name:
4-iodo-5-phenoxypent-4-en-2-ol
InChI:
InChI=1S/C11H13IO2/c1-9(13)7-10(12)8-14-11-5-3-2-4-6-11/h2-6,8-9,13H,7H2,1H3
InChI Key:
ZOCFSFNIAORTFA-UHFFFAOYSA-N
SMILES:
CC(C/C(=C/Oc1ccccc1)/I)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.996g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.127g/mol
Monoisotopic Mass:
303.996g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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