| CAS Number | 331851-71-9 |
| Catalog Number | AG01AAP6 |
| Chemical Name | 4-amino-N-(1-hydroxybutan-2-yl)benzamide |
| IUPAC Name | 4-amino-N-(1-hydroxybutan-2-yl)benzamide |
| InChI | InChI=1S/C11H16N2O2/c1-2-10(7-14)13-11(15)8-3-5-9(12)6-4-8/h3-6,10,14H,2,7,12H2,1H3,(H,13,15) |
| InChI Key | GAMWLCYIWNUQSS-UHFFFAOYSA-N |
| MDL Number | MFCD01056259 |
| Molecular Formula | C11H16N2O2 |
| Molecular Weight | 208.2569 |
| SMILES | CCC(NC(C1=CC=C(N)C=C1)=O)CO |
| Synonyms | 4-amino-N-(1-hydroxybutan-2-yl)benzamide,
331851-71-9,
AC1MK1FA,
AC1Q2SHA,
TimTec1_008441,
Oprea1_635397,
HMS1557P15,
AKOS000636534,
AKOS022483420,
MCULE-5179308979,
NE24817,
BAS 03421728,
4-Amino-N-(1-hydroxymethyl-propyl)-benzamide,
EN300-69218,
SR-01000318408,
SR-01000318408-1,
Z1263714133,
ZINC00301726,
CID3147218,
|
| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.261g/mol |
| Monoisotopic Mass | 208.121g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number