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88131-14-0 | Benzene, (2,2-diiodo-1-methoxyethenyl)-
CAS No: 88131-14-0 Catalog No: AG004HT5 MDL No:
Product Description
Catalog Number:
AG004HT5
Chemical Name:
Benzene, (2,2-diiodo-1-methoxyethenyl)-
CAS Number:
88131-14-0
Molecular Formula:
C9H8I2O
Molecular Weight:
385.9682
IUPAC Name:
(2,2-diiodo-1-methoxyethenyl)benzene
InChI:
InChI=1S/C9H8I2O/c1-12-8(9(10)11)7-5-3-2-4-6-7/h2-6H,1H3
InChI Key:
GINQVCYTSCQYSA-UHFFFAOYSA-N
SMILES:
COC(=C(I)I)c1ccccc1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.866g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
385.971g/mol
Monoisotopic Mass:
385.866g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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