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474416-59-6 | bis(2-iodothiophen-3-yl)methanol
CAS No: 474416-59-6 Catalog No: AG01BEES MDL No:MFCD28125009
Product Description
Catalog Number:
AG01BEES
Chemical Name:
bis(2-iodothiophen-3-yl)methanol
CAS Number:
474416-59-6
Molecular Formula:
C9H6I2OS2
Molecular Weight:
448.0823
MDL Number:
MFCD28125009
IUPAC Name:
bis(2-iodothiophen-3-yl)methanol
InChI:
InChI=1S/C9H6I2OS2/c10-8-5(1-3-13-8)7(12)6-2-4-14-9(6)11/h1-4,7,12H
InChI Key:
IFGLCBHJMMWROD-UHFFFAOYSA-N
SMILES:
OC(c1ccsc1I)c1ccsc1I
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
447.795g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
448.075g/mol
Monoisotopic Mass:
447.795g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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