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1255099-73-0 | 3-Benzofuranmethanol, 6-iodo-
CAS No: 1255099-73-0 Catalog No: AG000NS5 MDL No:
Product Description
Catalog Number:
AG000NS5
Chemical Name:
3-Benzofuranmethanol, 6-iodo-
CAS Number:
1255099-73-0
Molecular Formula:
C9H7IO2
Molecular Weight:
274.0552
IUPAC Name:
(6-iodo-1-benzofuran-3-yl)methanol
InChI:
InChI=1S/C9H7IO2/c10-7-1-2-8-6(4-11)5-12-9(8)3-7/h1-3,5,11H,4H2
InChI Key:
OGBKTSZBGVZCRV-UHFFFAOYSA-N
SMILES:
OCc1cc2c(o1)cc(cc2)I
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.057g/mol
Monoisotopic Mass:
273.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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