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827045-00-1 | Benzenemethanol, 2,5-diiodo-4-methyl-
CAS No: 827045-00-1 Catalog No: AG004VUQ MDL No:
Product Description
Catalog Number:
AG004VUQ
Chemical Name:
Benzenemethanol, 2,5-diiodo-4-methyl-
CAS Number:
827045-00-1
Molecular Formula:
C8H8I2O
Molecular Weight:
373.9575
IUPAC Name:
(2,5-diiodo-4-methylphenyl)methanol
InChI:
InChI=1S/C8H8I2O/c1-5-2-8(10)6(4-11)3-7(5)9/h2-3,11H,4H2,1H3
InChI Key:
RUAZJSWLQUOTBJ-UHFFFAOYSA-N
SMILES:
OCc1cc(I)c(cc1I)C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.866g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.96g/mol
Monoisotopic Mass:
373.866g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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