| CAS Number | 6760-22-1 |
| Catalog Number | AG00FEEB(AGN-PC-00N3MR) |
| Chemical Name | 2-Methylquinoline-4-carboxaldehyde |
| IUPAC Name | 2-methylquinoline-4-carbaldehyde |
| InChI | InChI=1S/C11H9NO/c1-8-6-9(7-13)10-4-2-3-5-11(10)12-8/h2-7H,1H3 |
| InChI Key | NZNFCDOWRMQIDH-UHFFFAOYSA-N |
| MDL Number | MFCD01715737 |
| Molecular Formula | C11H9NO |
| Molecular Weight | 171.1953 |
| SMILES | CC1=NC2=C(C=CC=C2)C(C=O)=C1 |
| Synonyms | 2-Methylquinoline-4-carboxaldehyde,
2-methylquinoline-4-carbaldehyde,
6760-22-1,
AC1Q2P84,
SCHEMBL1914529,
CTK5C6391,
DTXSID80543980,
NZNFCDOWRMQIDH-UHFFFAOYSA-N,
KM1119,
MFCD08052651,
ZINC14983290,
4-Quinolinecarboxaldehyde, 2-methyl-,
AKOS002669579,
AB43021,
MCULE-6434321147,
2-METHYL-4-QUINOLINECARBOXALDEHYDE,
DB-081637,
FT-0735396,
EN300-69859,
I14-11795,
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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 | 171.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.199g/mol |
| Monoisotopic Mass | 171.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number