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107616-61-5 | Benzene, 1-iodo-2-(4-pentenyloxy)-
CAS No: 107616-61-5 Catalog No: AG007EA4 MDL No:
Product Description
Catalog Number:
AG007EA4
Chemical Name:
Benzene, 1-iodo-2-(4-pentenyloxy)-
CAS Number:
107616-61-5
Molecular Formula:
C11H13IO
Molecular Weight:
288.1248
IUPAC Name:
1-iodo-2-pent-4-enoxybenzene
InChI:
InChI=1S/C11H13IO/c1-2-3-6-9-13-11-8-5-4-7-10(11)12/h2,4-5,7-8H,1,3,6,9H2
InChI Key:
IGHVHICIUUQRJG-UHFFFAOYSA-N
SMILES:
C=CCCCOc1ccccc1I
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.001g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.128g/mol
Monoisotopic Mass:
288.001g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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