| CAS Number | 35462-47-6 |
| Catalog Number | AG00CHAH(AGN-PC-00AHKL) |
| Chemical Name | 1-Cyano-4-naphthol |
| IUPAC Name | 4-hydroxynaphthalene-1-carbonitrile |
| InChI | InChI=1S/C11H7NO/c12-7-8-5-6-11(13)10-4-2-1-3-9(8)10/h1-6,13H |
| InChI Key | WRCUUNRCGDNUQJ-UHFFFAOYSA-N |
| MDL Number | MFCD17012543 |
| Molecular Formula | C11H7NO |
| Molecular Weight | 169.1794 |
| SMILES | OC1=C2C(C=CC=C2)=C(C#N)C=C1 |
| Synonyms | 35462-47-6,
4-hydroxynaphthalene-1-carbonitrile,
2-Cyano-4-hydroxynaphthalene,
1-Cyano-4-naphthol,
4-hydroxynaphtho-1-nitrile,
4-cyano-1-naphthol,
1-hydroxy-4-naphthonitrile,
4-hydroxy-2-naphthonitrile,
SCHEMBL4228113,
DTXSID70467702,
WRCUUNRCGDNUQJ-UHFFFAOYSA-N,
4-Hydroxy-1-naphthalenecarbonitrile,
1-CYANO-4-HYDROXYNAPHTHALENE,
ZINC71256637,
AKOS022516433,
FT-0770389,
Z2217033077,
4-hydroxy-1-naphthonitrile,
CID11506528,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.183g/mol |
| Monoisotopic Mass | 169.053g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 44A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number