| CAS Number | 1099619-96-1 |
| Catalog Number | AG01BCTT(AGN-PC-0WOSZP) |
| Chemical Name | [4-bromo-2-(morpholin-4-yl)phenyl]methanol |
| IUPAC Name | (4-bromo-2-morpholin-4-ylphenyl)methanol |
| InChI | InChI=1S/C11H14BrNO2/c12-10-2-1-9(8-14)11(7-10)13-3-5-15-6-4-13/h1-2,7,14H,3-6,8H2 |
| InChI Key | NPBHCJZPPACDHQ-UHFFFAOYSA-N |
| MDL Number | MFCD11651958 |
| Molecular Formula | C11H14BrNO2 |
| Molecular Weight | 272.1384 |
| SMILES | OCC1=C(N2CCOCC2)C=C(Br)C=C1 |
| Synonyms | [4-bromo-2-(morpholin-4-yl)phenyl]methanol,
1099619-96-1,
ZINC36670764,
AKOS009392854,
NE31375,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.142g/mol |
| Monoisotopic Mass | 271.021g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number