1H-1,2,4-Triazole-1-ethanol - CAS 3273-14-1
Catalog: |
BB021388 |
Product Name: |
1H-1,2,4-Triazole-1-ethanol |
CAS: |
3273-14-1 |
Synonyms: |
2-(1,2,4-triazol-1-yl)ethanol; 2-(1,2,4-triazol-1-yl)ethanol |
IUPAC Name: | 2-(1,2,4-triazol-1-yl)ethanol |
Description: | 1H-1,2,4-Triazole-1-ethanol (CAS# 3273-14-1) is a useful research chemical. |
Molecular Weight: | 113.12 |
Molecular Formula: | C4H7N3O |
Canonical SMILES: | C1=NN(C=N1)CCO |
InChI: | InChI=1S/C4H7N3O/c8-2-1-7-4-5-3-6-7/h3-4,8H,1-2H2 |
InChI Key: | CLVALLQETQTQMV-UHFFFAOYSA-N |
Boiling Point: | 299.6 °C at 760 mmHg |
Density: | 1.32 g/cm3 |
MDL: | MFCD00607979 |
LogP: | -0.72960 |
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 |
Publication Number | Title | Priority Date |
WO-2021083380-A1 | Eed inhibitor, and preparation method therefor and use thereof | 20191101 |
WO-2020247804-A1 | Heterocycle substituted pyridine derivative antifungal agents | 20190607 |
US-2019388397-A1 | Compositions and methods for the treatment and prevention of neurological disorders | 20180621 |
WO-2019246494-A1 | Compositions and methods for the treatment and prevention of neurological disorders | 20180621 |
WO-2019246494-A9 | Compositions and methods for the treatment and prevention of neurological disorders | 20180621 |
PMID | Publication Date | Title | Journal |
17329057 | 20070411 | Radiochemical stability of fluconazole in the solid state | Journal of pharmaceutical and biomedical analysis |
Complexity: | 68.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 113.058911855 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 113.058911855 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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