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1250357-51-7 | 2-Thiophenemethanol, α-(5-bromo-2-fluorophenyl)-
CAS No: 1250357-51-7 Catalog No: AG000N02 MDL No:
Product Description
Catalog Number:
AG000N02
Chemical Name:
2-Thiophenemethanol, α-(5-bromo-2-fluorophenyl)-
CAS Number:
1250357-51-7
Molecular Formula:
C11H8BrFOS
Molecular Weight:
287.1480
IUPAC Name:
(5-bromo-2-fluorophenyl)-thiophen-2-ylmethanol
InChI:
InChI=1S/C11H8BrFOS/c12-7-3-4-9(13)8(6-7)11(14)10-2-1-5-15-10/h1-6,11,14H
InChI Key:
ZENSFSRYSCOPPG-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C(c1cccs1)O)F
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.946g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.146g/mol
Monoisotopic Mass:
285.946g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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