L-Isoleucinol - CAS 24629-25-2
Catalog: |
BB018560 |
Product Name: |
L-Isoleucinol |
CAS: |
24629-25-2 |
Synonyms: |
H-Ile-ol; (2S,3S)-2-Amino-3-methyl-1-pentanol; H-Isoleucinol; L-(+)-Isoleucinol |
IUPAC Name: | (2S,3S)-2-amino-3-methylpentan-1-ol |
Description: | L-Isoleucinol (CAS# 24629-25-2) is a useful research chemical. |
Molecular Weight: | 117.2 |
Molecular Formula: | C6H15NO |
Canonical SMILES: | CCC(C)C(CO)N |
InChI: | InChI=1S/C6H15NO/c1-3-5(2)6(7)4-8/h5-6,8H,3-4,7H2,1-2H3/t5-,6+/m0/s1 |
InChI Key: | VTQHAQXFSHDMHT-NTSWFWBYSA-N |
Boiling Point: | 97 ℃ at 14 mmHg |
Melting Point: | 36-39 ℃ |
Purity: | ≥ 99 % (Assay) |
Density: | 0.905 g/cm3 |
Appearance: | White to light yellow liquid |
Storage: | Store at 2-8 ℃ |
MDL: | MFCD00004731 |
LogP: | 1.05240 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22994321 | 20121101 | 20-Residue and 11-residue peptaibols from the fungus Trichoderma longibrachiatum are synergistic in forming Na+/K+ -permeable channels and adverse action towards mammalian cells | The FEBS journal |
20717555 | 20101014 | Synthesis of chiral β-aminoalcohol palladium complexes exhibiting cytotoxic properties | Dalton transactions (Cambridge, England : 2003) |
19097890 | 20090201 | (S)-N-(5-Chlorothiophene-2-sulfonyl)-beta,beta-diethylalaninol a Notch-1-sparing gamma-secretase inhibitor | Bioorganic & medicinal chemistry letters |
17480038 | 20070601 | Polymeric alkenoxy amino acid surfactants: V. Comparison of carboxylate and sulfate head group polymeric surfactants for enantioseparation in MEKC | Electrophoresis |
17589878 | 20070601 | Peptaibiomics: microheterogeneity, dynamics, and sequences of trichobrachins, peptaibiotics from Trichoderma parceramosum Bissett (T. longibrachiatum Rifai) | Chemistry & biodiversity |
Complexity: | 56.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 117.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 117.115364102 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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