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51632-08-7 | (4,5,6,7-Tetrahydro-1-benzothiophen-2-yl)methanol
CAS No: 51632-08-7 Catalog No: AG01FGK0 MDL No:
Product Description
Catalog Number:
AG01FGK0
Chemical Name:
(4,5,6,7-Tetrahydro-1-benzothiophen-2-yl)methanol
CAS Number:
51632-08-7
IUPAC Name:
4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethanol
InChI:
InChI=1S/C9H12OS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h5,10H,1-4,6H2
InChI Key:
IVGGIPRWOPTYOJ-UHFFFAOYSA-N
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.254g/mol
Monoisotopic Mass:
168.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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