(S)-3-Amino-1-butanol - CAS 61477-39-2
Catalog: |
BB031134 |
Product Name: |
(S)-3-Amino-1-butanol |
CAS: |
61477-39-2 |
Synonyms: |
(3S)-3-amino-1-butanol; (3S)-3-aminobutan-1-ol |
IUPAC Name: | (3S)-3-aminobutan-1-ol |
Description: | (S)-3-Aminobutan-1-ol can be used as an intermediate in the preparation of compounds having HIV integrase inhibitory activity. |
Molecular Weight: | 89.14 |
Molecular Formula: | C4H11NO |
Canonical SMILES: | CC(CCO)N |
InChI: | InChI=1S/C4H11NO/c1-4(5)2-3-6/h4,6H,2-3,5H2,1H3/t4-/m0/s1 |
InChI Key: | AGMZSYQMSHMXLT-BYPYZUCNSA-N |
Boiling Point: | 168.349 °C at 760 mmHg |
Density: | 0.927 g/cm3 |
Appearance: | Solid |
LogP: | 0.41630 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112852895-A | Method for synthesizing (R) -3-amino-1-butanol by double-enzyme cascade catalysis | 20201201 |
WO-2021098817-A1 | Dioxopiperazine derivative, preparation method therefore and pharmaceutical use thereof | 20191121 |
CN-110818578-A | Catalytic hydrogenation synthesis method of chiral aminobutanol | 20191025 |
US-2021009262-A1 | Tetracyclic heterocycle compounds useful as hiv integrase inhibitors | 20190620 |
WO-2020205501-A1 | Complement modulators and related methods | 20190329 |
PMID | Publication Date | Title | Journal |
21254431 | 20110201 | Synthetic studies toward galbulimima alkaloid (-)-GB 13 and (+)-GB 16 and (-)-himgaline | Chemistry, an Asian journal |
Complexity: | 30.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 89.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 89.084063974 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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