Home Other Building Blocks Benzo[b]thiophene-5-methanol

Benzo[b]thiophene-5-methanol

CAS No.:
20532-34-7
Catalog Number:
AG002A0L
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
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Product Description
Catalog Number:
AG002A0L
Chemical Name:
Benzo[b]thiophene-5-methanol
CAS Number:
20532-34-7
Molecular Formula:
C9H8OS
Molecular Weight:
164.2242
MDL Number:
MFCD04972640
IUPAC Name:
1-benzothiophen-5-ylmethanol
InChI:
InChI=1S/C9H8OS/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,10H,6H2
InChI Key:
JSYSQUAJOCDMJW-UHFFFAOYSA-N
SMILES:
OCc1ccc2c(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:
1  
Isotope Atom Count:
0
Molecular Weight:
164.222g/mol
Monoisotopic Mass:
164.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties