| CAS Number | 67608-57-5 |
| Catalog Number | AG00FB7P(AGN-PC-0NJ2OQ) |
| Chemical Name | 3-Amino-2-hydroxybenzonitrile |
| IUPAC Name | 3-amino-2-hydroxybenzonitrile |
| InChI | InChI=1S/C7H6N2O/c8-4-5-2-1-3-6(9)7(5)10/h1-3,10H,9H2 |
| InChI Key | FMQVUWGTHZPXQU-UHFFFAOYSA-N |
| MDL Number | MFCD02261942 |
| Molecular Formula | C7H6N2O |
| Molecular Weight | 134.1353 |
| SMILES | NC1=C(O)C(C#N)=CC=C1 |
| Synonyms | 3-AMINO-2-HYDROXYBENZONITRILE,
67608-57-5,
BENZONITRILE, 3-AMINO-2-HYDROXY-,
3-amino-2-hydroxy-benzonitrile,
2-amino-6-cyanophenol,
2-Hydroxy-3-aminobenzonitrile,
SCHEMBL105537,
CTK5C6395,
DTXSID10499461,
FMQVUWGTHZPXQU-UHFFFAOYSA-N,
ZINC2581338,
MFCD02261942,
AKOS006341714,
AS06489,
CM10899,
MB02411,
FT-0716249,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 134.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 134.138g/mol |
| Monoisotopic Mass | 134.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 70A^2 |
| 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