| CAS Number | 4138-23-2 |
| Catalog Number | AG01A9QF(AGN-PC-0WO4AG) |
| Chemical Name | 1,2,3,4-tetrahydroquinoline-3-carboxamide |
| IUPAC Name | 1,2,3,4-tetrahydroquinoline-3-carboxamide |
| InChI | InChI=1S/C10H12N2O/c11-10(13)8-5-7-3-1-2-4-9(7)12-6-8/h1-4,8,12H,5-6H2,(H2,11,13) |
| InChI Key | NYENCZIONJUOSQ-UHFFFAOYSA-N |
| MDL Number | MFCD16817429 |
| Molecular Formula | C10H12N2O |
| Molecular Weight | 176.2151 |
| SMILES | NC(C1CC2=C(C=CC=C2)NC1)=O |
| Synonyms | 1,2,3,4-tetrahydroquinoline-3-carboxamide,
4138-23-2,
AC1Q4ZJA,
3-Quinolinecarboxamide, 1,2,3,4-tetrahydro-,
SCHEMBL6419360,
Tetrahydro-3-Chinolin-Carboxamide,
AKOS012170704,
MCULE-9617431368,
NE16101,
EN300-65836,
Z1262398459,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.219g/mol |
| Monoisotopic Mass | 176.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number