Home Other Building Blocks Benzo[b]thiophene, 6-methyl-

Benzo[b]thiophene, 6-methyl-

CAS No.:
16587-47-6
Catalog Number:
AG001WE4
Molecular Formula:
C9H8S
Molecular Weight:
148.2248
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Product Description
Catalog Number:
AG001WE4
Chemical Name:
Benzo[b]thiophene, 6-methyl-
CAS Number:
16587-47-6
Molecular Formula:
C9H8S
Molecular Weight:
148.2248
MDL Number:
MFCD02683997
IUPAC Name:
6-methyl-1-benzothiophene
InChI:
InChI=1S/C9H8S/c1-7-2-3-8-4-5-10-9(8)6-7/h2-6H,1H3
InChI Key:
WOGMIMNVXACKEB-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)scc2
EC Number:
250-609-2
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.035g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.223g/mol
Monoisotopic Mass:
148.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties