2-(1H-1,2,3-Triazol-1-yl)acetic Acid - CAS 4314-22-1
Catalog: |
BB025338 |
Product Name: |
2-(1H-1,2,3-Triazol-1-yl)acetic Acid |
CAS: |
4314-22-1 |
Synonyms: |
2-(1-triazolyl)acetic acid; 2-(triazol-1-yl)acetic acid |
IUPAC Name: | 2-(triazol-1-yl)acetic acid |
Description: | 2-(1H-1,2,3-Triazol-1-yl)acetic Acid (CAS# 4314-22-1) is a useful reagent in preparation of cyclic amine derivative as retinoid-related orphan receptor γ antagonist. |
Molecular Weight: | 127.10 |
Molecular Formula: | C4H5N3O2 |
Canonical SMILES: | C1=CN(N=N1)CC(=O)O |
InChI: | InChI=1S/C4H5N3O2/c8-4(9)3-7-2-1-5-6-7/h1-2H,3H2,(H,8,9) |
InChI Key: | YUHHBTFHHCASIC-UHFFFAOYSA-N |
Boiling Point: | 386.9 °C at 760 mmHg |
Density: | 2.14 g/cm3 |
MDL: | MFCD09029581 |
LogP: | -0.63730 |
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 |
CN-112390830-A | Iridium catalyst for catalyzing rearrangement of propargyl ester to prepare substituted ketone compound | 20201117 |
CN-111974456-A | Copper catalyst for propargyl alcohol rearrangement and preparation method thereof | 20200828 |
JP-2019089720-A | Compound or pharmaceutically acceptable salt thereof, myogenesis promoter, muscular atrophy inhibitor, pharmaceutical composition, and taz activator | 20171113 |
CN-109666130-A | A kind of energy-absorbing method based on dynamic aggregation object | 20171017 |
CN-109666158-A | A kind of hydridization dynamic aggregation object and its application | 20171017 |
Complexity: | 116 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.038176411 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.038176411 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 68 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS