Home Other Building Blocks Benzo[b]thiophene, 5-methoxy-

Benzo[b]thiophene, 5-methoxy-

CAS No.:
20532-30-3
Catalog Number:
AG002A0N
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002A0N
Chemical Name:
Benzo[b]thiophene, 5-methoxy-
CAS Number:
20532-30-3
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
MDL Number:
MFCD01860057
IUPAC Name:
5-methoxy-1-benzothiophene
InChI:
InChI=1S/C9H8OS/c1-10-8-2-3-9-7(6-8)4-5-11-9/h2-6H,1H3
InChI Key:
YUCSRVKBVKJMNH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccs2
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.222g/mol
Monoisotopic Mass:
164.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Synthesis and studies on spectroscopic as well as electron donating properties of the two alkoxy benzo[b]thiophenes. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20011201
Properties