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164071-58-3 | 2-Thiophenemethanol, α-(2-iodoethyl)-, (αS)-
CAS No: 164071-58-3 Catalog No: AG001UM5 MDL No:
Product Description
Catalog Number:
AG001UM5
Chemical Name:
2-Thiophenemethanol, α-(2-iodoethyl)-, (αS)-
CAS Number:
164071-58-3
Molecular Formula:
C7H9IOS
Molecular Weight:
268.1152
IUPAC Name:
3-iodo-1-thiophen-2-ylpropan-1-ol
InChI:
InChI=1S/C7H9IOS/c8-4-3-6(9)7-2-1-5-10-7/h1-2,5-6,9H,3-4H2
InChI Key:
KRZSQNQECJUPRL-UHFFFAOYSA-N
SMILES:
ICC[C@@H](c1cccs1)O
Properties
Complexity:
99.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.942g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.112g/mol
Monoisotopic Mass:
267.942g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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