4-(3-Hydroxypropyl)-4H-1,2,4-triazole - CAS 27106-94-1
Catalog: |
BB019465 |
Product Name: |
4-(3-Hydroxypropyl)-4H-1,2,4-triazole |
CAS: |
27106-94-1 |
Synonyms: |
3-(1,2,4-triazol-4-yl)-1-propanol; 3-(1,2,4-triazol-4-yl)propan-1-ol |
IUPAC Name: | 3-(1,2,4-triazol-4-yl)propan-1-ol |
Description: | 4-(3-Hydroxypropyl)-4H-1,2,4-triazole (CAS# 27106-94-1) is a useful research chemical. |
Molecular Weight: | 127.14 |
Molecular Formula: | C5H9N3O |
Canonical SMILES: | C1=NN=CN1CCCO |
InChI: | InChI=1S/C5H9N3O/c9-3-1-2-8-4-6-7-5-8/h4-5,9H,1-3H2 |
InChI Key: | PSFQZUIYYGSLQU-UHFFFAOYSA-N |
Boiling Point: | 310.3 °C at 760 mmHg |
Density: | 1.24 g/cm3 |
MDL: | MFCD03840804 |
LogP: | -0.33950 |
Publication Number | Title | Priority Date |
US-2021186935-A1 | Rapamycin analogs and uses thereof | 20191205 |
WO-2021113665-A1 | Rapamycin analogs and uses thereof | 20191205 |
CN-111278457-A | Compositions and methods for treating cancer and infection using bacteriophage and mutants thereof | 20170828 |
CN-110177785-A | A kind of dihydroisoquinoliness compound | 20170113 |
US-10597420-B2 | Derivatives of amphotericin B | 20150415 |
PMID | Publication Date | Title | Journal |
12489532 | 20021104 | A spin transition molecular material with a wide bistability domain | Chemistry (Weinheim an der Bergstrasse, Germany) |
Complexity: | 72.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.074561919 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.074561919 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1 |
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