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141809-77-0

141809-77-0 | Benzo[b]thiophene, 5-methoxy-2-(4-methoxyphenyl)-3-methyl-

CAS No: 141809-77-0 Catalog No: AG007Z5M MDL No:

Product Description

Catalog Number:
AG007Z5M
Chemical Name:
Benzo[b]thiophene, 5-methoxy-2-(4-methoxyphenyl)-3-methyl-
CAS Number:
141809-77-0
Molecular Formula:
C17H16O2S
Molecular Weight:
284.3727
IUPAC Name:
5-methoxy-2-(4-methoxyphenyl)-3-methyl-1-benzothiophene
InChI:
InChI=1S/C17H16O2S/c1-11-15-10-14(19-3)8-9-16(15)20-17(11)12-4-6-13(18-2)7-5-12/h4-10H,1-3H3
InChI Key:
PZWDMHSIPDKTPR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1sc2c(c1C)cc(cc2)OC

Properties

Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.087g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.373g/mol
Monoisotopic Mass:
284.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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