Home Halogens 3-bromo-1-benzothiophen-4-ol

3-bromo-1-benzothiophen-4-ol

CAS No.:
34576-99-3
Catalog Number:
AG01B1WN
Molecular Formula:
C8H5BrOS
Molecular Weight:
229.0937
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Product Description
Catalog Number:
AG01B1WN
Chemical Name:
3-bromo-1-benzothiophen-4-ol
CAS Number:
34576-99-3
Molecular Formula:
C8H5BrOS
Molecular Weight:
229.0937
MDL Number:
MFCD27921262
IUPAC Name:
3-bromo-1-benzothiophen-4-ol
InChI:
InChI=1S/C8H5BrOS/c9-5-4-11-7-3-1-2-6(10)8(5)7/h1-4,10H
InChI Key:
BIXYSKIJYNQIGR-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1c(Br)cs2
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.924g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.091g/mol
Monoisotopic Mass:
227.924g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties