3-(1H-Tetrazol-1-yl)propanoic acid - CAS 92614-86-3
Catalog: |
BB040569 |
Product Name: |
3-(1H-Tetrazol-1-yl)propanoic acid |
CAS: |
92614-86-3 |
Synonyms: |
3-(tetrazol-1-yl)propanoic acid |
IUPAC Name: | 3-(tetrazol-1-yl)propanoic acid |
Description: | 3-(1H-Tetrazol-1-yl)propanoic acid (CAS# 92614-86-3) is a useful research chemical compound. |
Molecular Weight: | 142.12 |
Molecular Formula: | C4H6N4O2 |
Canonical SMILES: | C1=NN=NN1CCC(=O)O |
InChI: | InChI=1S/C4H6N4O2/c9-4(10)1-2-8-3-5-6-7-8/h3H,1-2H2,(H,9,10) |
InChI Key: | WMTYEYUOSFTJBH-UHFFFAOYSA-N |
Boiling Point: | 377 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.61 g/cm3 |
MDL: | MFCD03724085 |
LogP: | -0.85220 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021025133-A1 | Photosensitive resin composition and photosensitive element | 20190806 |
TW-201925413-A | Chemical mechanical polishing composition | 20171122 |
WO-2019101555-A1 | Chemical mechanical polishing composition | 20171122 |
CN-111356747-A | Chemical mechanical polishing composition | 20171122 |
EP-3714012-A1 | Chemical mechanical polishing composition | 20171122 |
PMID | Publication Date | Title | Journal |
22590102 | 20120501 | Poly[[bis-[3-(1H-tetra-zol-1-yl)propanoic acid-κN(4)]cadmium]-di-μ-thio-cyanato-κ(2)N:S;κ(2)S:N] | Acta crystallographica. Section E, Structure reports online |
Complexity: | 128 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.04907545 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.04907545 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 80.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1 |
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