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1864060-77-4 | [4-(2-iodoethynyl)phenyl]methanol
CAS No: 1864060-77-4 Catalog No: AG01AP1G MDL No:MFCD29034358
Product Description
Catalog Number:
AG01AP1G
Chemical Name:
[4-(2-iodoethynyl)phenyl]methanol
CAS Number:
1864060-77-4
Molecular Formula:
C9H7IO
Molecular Weight:
258.0557
MDL Number:
MFCD29034358
IUPAC Name:
[4-(2-iodoethynyl)phenyl]methanol
InChI:
InChI=1S/C9H7IO/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4,11H,7H2
InChI Key:
WIMFLHFWKKSMIN-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)C#CI
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.954g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.058g/mol
Monoisotopic Mass:
257.954g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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