4-(1H-Tetrazol-5-yl)benzyl Alcohol - CAS 501126-02-9
Catalog: |
BB026924 |
Product Name: |
4-(1H-Tetrazol-5-yl)benzyl Alcohol |
CAS: |
501126-02-9 |
Synonyms: |
[4-(2H-tetrazol-5-yl)phenyl]methanol; [4-(2H-tetrazol-5-yl)phenyl]methanol |
IUPAC Name: | [4-(2H-tetrazol-5-yl)phenyl]methanol |
Description: | 4-(1H-Tetrazol-5-yl)benzyl Alcohol (CAS# 501126-02-9 ) is a useful research chemical. |
Molecular Weight: | 176.18 |
Molecular Formula: | C8H8N4O |
Canonical SMILES: | C1=CC(=CC=C1CO)C2=NNN=N2 |
InChI: | InChI=1S/C8H8N4O/c13-5-6-1-3-7(4-2-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12) |
InChI Key: | YRBYIQONKVQONA-UHFFFAOYSA-N |
Boiling Point: | 422.4 °C at 760 mmHg |
Density: | 1.392 g/cm3 |
MDL: | MFCD09909570 |
LogP: | 0.35900 |
Publication Number | Title | Priority Date |
US-2014206825-A1 | Supported alkoxylated organotin reactant, preparation and use for heterogeneous-phase synthesis of tetrazoles | 20110630 |
US-9724673-B2 | Supported alkoxylated organotin reactant, preparation and use for heterogeneous-phase synthesis of tetrazoles | 20110630 |
US-2013225819-A1 | Use of azides in synthesis | 20100818 |
DE-60211530-T2 | PYRROLOPYRIMIDINES AS A MEANS FOR INHIBITING CYSTONE PROTEASES | 20010830 |
EP-1423391-A1 | Pyrrolo pyrimidines as agents for the inhibition of cystein proteases | 20010830 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.06981089 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.06981089 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 74.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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