N-Z-D-Alaninol - CAS 61425-27-2
Catalog: |
BB031101 |
Product Name: |
N-Z-D-Alaninol |
CAS: |
61425-27-2 |
Synonyms: |
Cbz-D-Alaninol; Z-D-Ala-ol; N-Carbobenzoxy-D-alaninol; (R)-2-(Carbobenzoxyamino)-1-propanol; (R)-Benzyl (1-hydroxypropan-2-yl)carbamate |
IUPAC Name: | benzyl N-[(2R)-1-hydroxypropan-2-yl]carbamate |
Description: | N-Z-D-Alaninol (CAS# 61425-27-2) is a useful research chemical compound. |
Molecular Weight: | 209.24 |
Molecular Formula: | C11H15NO3 |
Canonical SMILES: | CC(CO)NC(=O)OCC1=CC=CC=C1 |
InChI: | InChI=1S/C11H15NO3/c1-9(7-13)12-11(14)15-8-10-5-3-2-4-6-10/h2-6,9,13H,7-8H2,1H3,(H,12,14)/t9-/m1/s1 |
InChI Key: | AFPHMHSLDRPUSM-SECBINFHSA-N |
Boiling Point: | 375.2 °C at 760 mmHg |
Density: | 1.149 g/cm3 |
Appearance: | Solid |
Storage: | Store at 2-8 °C |
MDL: | MFCD00672531 |
LogP: | 1.68450 |
Publication Number | Title | Priority Date |
WO-2021055728-A1 | Small molecule inhibitors of kras g12c mutant | 20190918 |
EP-3674288-A1 | Pantothenamide analogues | 20181231 |
WO-2020141155-A1 | Pantothenamide analogues | 20181231 |
WO-2020095215-A1 | Chemical compounds | 20181108 |
CN-112969698-A | Chemical compound | 20181108 |
Complexity: | 190 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.10519334 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 58.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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