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13771-73-8 | Benzo[b]thiophene-2-methanol, 5-fluoro-
CAS No: 13771-73-8 Catalog No: AG0013RM MDL No:MFCD11841046
Product Description
Catalog Number:
AG0013RM
Chemical Name:
Benzo[b]thiophene-2-methanol, 5-fluoro-
CAS Number:
13771-73-8
Molecular Formula:
C9H7FOS
Molecular Weight:
182.2147
MDL Number:
MFCD11841046
IUPAC Name:
(5-fluoro-1-benzothiophen-2-yl)methanol
InChI:
InChI=1S/C9H7FOS/c10-7-1-2-9-6(3-7)4-8(5-11)12-9/h1-4,11H,5H2
InChI Key:
MLMIMHHVDSBESY-UHFFFAOYSA-N
SMILES:
OCc1cc2c(s1)ccc(c2)F
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.212g/mol
Monoisotopic Mass:
182.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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