| CAS Number | 1153552-30-7 |
| Catalog Number | AG01A9PE |
| Chemical Name | N-(2-hydroxyethyl)-3-(4-methylphenyl)propanamide |
| IUPAC Name | N-(2-hydroxyethyl)-3-(4-methylphenyl)propanamide |
| InChI | InChI=1S/C12H17NO2/c1-10-2-4-11(5-3-10)6-7-12(15)13-8-9-14/h2-5,14H,6-9H2,1H3,(H,13,15) |
| InChI Key | AWMWBUBNLBTXON-UHFFFAOYSA-N |
| MDL Number | MFCD12179595 |
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| SMILES | CC1=CC=C(CCC(NCCO)=O)C=C1 |
| Synonyms | N-(2-hydroxyethyl)-3-(4-methylphenyl)propanamide,
1153552-30-7,
AC1Q2LWB,
ZINC35118323,
AKOS009091914,
MCULE-8175835463,
NE15455,
EN300-65742,
Z194856678,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.273g/mol |
| Monoisotopic Mass | 207.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number