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179862-30-7 | Benzene, 1-iodo-2-[[(2-methyl-2-propen-1-yl)oxy]methyl]-
CAS No: 179862-30-7 Catalog No: AG0027BD MDL No:
Product Description
Catalog Number:
AG0027BD
Chemical Name:
Benzene, 1-iodo-2-[[(2-methyl-2-propen-1-yl)oxy]methyl]-
CAS Number:
179862-30-7
Molecular Formula:
C11H13IO
Molecular Weight:
288.1248
IUPAC Name:
1-iodo-2-(2-methylprop-2-enoxymethyl)benzene
InChI:
InChI=1S/C11H13IO/c1-9(2)7-13-8-10-5-3-4-6-11(10)12/h3-6H,1,7-8H2,2H3
InChI Key:
KZCYHMFXGRLPFW-UHFFFAOYSA-N
SMILES:
CC(=C)COCc1ccccc1I
Properties
Complexity:
168
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:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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