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144104-54-1 | 1H-Indole, 5-(2-thienyl)-
CAS No: 144104-54-1 Catalog No: AG001IYU MDL No:MFCD04114723
Product Description
Catalog Number:
AG001IYU
Chemical Name:
1H-Indole, 5-(2-thienyl)-
CAS Number:
144104-54-1
Molecular Formula:
C12H9NS
Molecular Weight:
199.2716
MDL Number:
MFCD04114723
IUPAC Name:
5-thiophen-2-yl-1H-indole
InChI:
InChI=1S/C12H9NS/c1-2-12(14-7-1)10-3-4-11-9(8-10)5-6-13-11/h1-8,13H
InChI Key:
VISKSMAQBGNNNH-UHFFFAOYSA-N
SMILES:
c1csc(c1)c1ccc2c(c1)cc[nH]2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.271g/mol
Monoisotopic Mass:
199.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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