| CAS Number | 27519-68-2 |
| Catalog Number | AG00I57K(AGN-PC-0LYXY5) |
| Chemical Name | Benzamide, 4-hydroxy-N-propyl- |
| IUPAC Name | 4-hydroxy-N-propylbenzamide |
| InChI | InChI=1S/C10H13NO2/c1-2-7-11-10(13)8-3-5-9(12)6-4-8/h3-6,12H,2,7H2,1H3,(H,11,13) |
| InChI Key | FOHAXXVIYAVXST-UHFFFAOYSA-N |
| MDL Number | MFCD06253037 |
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.2157 |
| SMILES | O=C(NCCC)C1=CC=C(O)C=C1 |
| Synonyms | 4-hydroxy-N-propylbenzamide,
27519-68-2,
Benzamide, 4-hydroxy-N-propyl-,
AC1OKXID,
SCHEMBL166778,
CHEMBL397585,
ZINC4816389,
STK222160,
AKOS000207273,
MCULE-5121820365,
ZINC04816389,
CID7370146,
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| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.219g/mol |
| Monoisotopic Mass | 179.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number