| CAS Number | 1670-88-8 |
| Catalog Number | AG00B281(AGN-PC-0JTHEK) |
| Chemical Name | 1H-Indole-6-carboxamide(9CI) |
| IUPAC Name | 1H-indole-6-carboxamide |
| InChI | InChI=1S/C9H8N2O/c10-9(12)7-2-1-6-3-4-11-8(6)5-7/h1-5,11H,(H2,10,12) |
| InChI Key | KJLFFCRGGGXQKE-UHFFFAOYSA-N |
| MDL Number | MFCD13176771 |
| Molecular Formula | C9H8N2O |
| Molecular Weight | 160.1726 |
| SMILES | O=C(C1=CC2=C(C=C1)C=CN2)N |
| Synonyms | 1H-Indole-6-carboxamide,
1670-88-8,
KJLFFCRGGGXQKE-UHFFFAOYSA-N,
Indole-7-carboxamide,
Indole-6-carboxamide,
AC1LC5RU,
SCHEMBL50552,
1H-Indole-6-carboxamide(9CI),
BDBM93022,
CTK0H1667,
DTXSID40344172,
ZINC32199229,
AKOS010301800,
CID594837,
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| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 160.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.176g/mol |
| Monoisotopic Mass | 160.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number