(S)-1-Boc-3-(hydroxymethyl)piperazine - CAS 314741-40-7
Catalog: |
BB020937 |
Product Name: |
(S)-1-Boc-3-(hydroxymethyl)piperazine |
CAS: |
314741-40-7 |
Synonyms: |
(3S)-3-(hydroxymethyl)-1-piperazinecarboxylic acid tert-butyl ester; tert-butyl (3S)-3-(hydroxymethyl)piperazine-1-carboxylate |
IUPAC Name: | tert-butyl (3S)-3-(hydroxymethyl)piperazine-1-carboxylate |
Description: | (S)-1-Boc-3-(hydroxymethyl)piperazine (CAS# 314741-40-7) is a useful research chemical. |
Molecular Weight: | 216.28 |
Molecular Formula: | C10H20N2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCNC(C1)CO |
InChI: | InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-11-8(6-12)7-13/h8,11,13H,4-7H2,1-3H3/t8-/m0/s1 |
InChI Key: | NSILYQWHARROMG-QMMMGPOBSA-N |
Boiling Point: | 322.9 ℃ at 760 mmHg |
Density: | 1.085 g/cm3 |
MDL: | MFCD05863889 |
LogP: | 0.45430 |
Publication Number | Title | Priority Date |
WO-2021121276-A1 | Fused tetracyclic derivative, preparation method therefor, and medical use thereof | 20191217 |
WO-2021108683-A1 | Covalent ras inhibitors and uses thereof | 20191127 |
WO-2021083167-A1 | Substituted heterocyclic fused cyclic compound, preparation method therefor and pharmaceutical use thereof | 20191030 |
CN-112390818-A | Substituted heteroaromatic dihydro pyrimidone derivatives, preparation method and medical application thereof | 20190812 |
WO-2021023154-A1 | Tetracyclic compound, preparation method therefor and use thereof | 20190802 |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.1473925 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.1473925 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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