| CAS Number | 865376-76-7 |
| Catalog Number | AG004V4D(AGN-PC-07RC6S) |
| Chemical Name | 6-(Thiophen-3-yl)-1H-indole |
| IUPAC Name | 6-thiophen-3-yl-1H-indole |
| InChI | InChI=1S/C12H9NS/c1-2-10(11-4-6-14-8-11)7-12-9(1)3-5-13-12/h1-8,13H |
| InChI Key | NAIXVPHCNHBCOF-UHFFFAOYSA-N |
| MDL Number | MFCD04114737 |
| Molecular Formula | C12H9NS |
| Molecular Weight | 199.2716 |
| SMILES | C1NC2=C(C=CC(C3=CSC=C3)=C2)C=1 |
| Synonyms | 6-(Thiophen-3-yl)-1H-indole,
865376-76-7,
6-THIOPHEN-3-YL-1H-INDOLE,
1H-Indole,6-(3-thienyl)-,
SCHEMBL2461816,
CTK5F6924,
DTXSID70673164,
ZINC2526992,
3628AJ,
AKOS006292397,
AJ-37776,
DB-076679,
FT-0695695,
Z-6618,
C12H9NS,
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| 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 | 3.4 |
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Certificate of Analysis
Lot Number