| CAS Number | 586413-05-0 |
| Catalog Number | AG00F2PI(AGN-PC-0OCRHR) |
| Chemical Name | 5-Hydroxyquinoline-2-carbonitrile |
| IUPAC Name | 5-hydroxyquinoline-2-carbonitrile |
| InChI | InChI=1S/C10H6N2O/c11-6-7-4-5-8-9(12-7)2-1-3-10(8)13/h1-5,13H |
| InChI Key | PBXWFTPUPUVGHW-UHFFFAOYSA-N |
| MDL Number | MFCD18415939 |
| Molecular Formula | C10H6N2O |
| Molecular Weight | 170.1674 |
| SMILES | N#CC1=NC2=CC=CC(O)=C2C=C1 |
| Synonyms | 5-Hydroxyquinoline-2-carbonitrile,
586413-05-0,
2-Cyano-5-hydroxyquinoline,
2-cyano-5-hydroxylquinoline,
SCHEMBL5181894,
PBXWFTPUPUVGHW-UHFFFAOYSA-N,
5-oxo-1H-quinoline-2-carbonitrile,
2-Quinolinecarbonitrile, 5-hydroxy-,
ZINC88189769,
AKOS025290911,
FCH1135945,
SB11035,
KS-0000048A,
AK170870,
AS-33899,
CS-0050457,
Q-5011,
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| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.048013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.17g/mol |
| Monoisotopic Mass | 170.048013g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 56.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number