200,000+ products from a single source!
sales@angenechem.com
124168-55-4 | Benzo[b]thiophene-2-methanol, 3-chloro-
CAS No: 124168-55-4 Catalog No: AG000LMJ MDL No:MFCD03229984
Product Description
Catalog Number:
AG000LMJ
Chemical Name:
Benzo[b]thiophene-2-methanol, 3-chloro-
CAS Number:
124168-55-4
Molecular Formula:
C9H7ClOS
Molecular Weight:
198.6693
MDL Number:
MFCD03229984
IUPAC Name:
(3-chloro-1-benzothiophen-2-yl)methanol
InChI:
InChI=1S/C9H7ClOS/c10-9-6-3-1-2-4-7(6)12-8(9)5-11/h1-4,11H,5H2
InChI Key:
CPGKUHFGNJQXKY-UHFFFAOYSA-N
SMILES:
OCc1sc2c(c1Cl)cccc2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.991g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.664g/mol
Monoisotopic Mass:
197.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.