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93398-61-9 | 5-Octenoic acid, 8-iodo-, (Z)-
CAS No: 93398-61-9 Catalog No: AG0063L5 MDL No:
Product Description
Catalog Number:
AG0063L5
Chemical Name:
5-Octenoic acid, 8-iodo-, (Z)-
CAS Number:
93398-61-9
Molecular Formula:
C8H13IO2
Molecular Weight:
268.0921
IUPAC Name:
8-iodooct-5-enoic acid
InChI:
InChI=1S/C8H13IO2/c9-7-5-3-1-2-4-6-8(10)11/h1,3H,2,4-7H2,(H,10,11)
InChI Key:
HXVOUJWYEHGHQX-UHFFFAOYSA-N
SMILES:
ICC/C=C\CCCC(=O)O
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.996g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.094g/mol
Monoisotopic Mass:
267.996g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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