4-Thiazoleboronic Acid - CAS 1016642-07-1
Catalog: |
BB000587 |
Product Name: |
4-Thiazoleboronic Acid |
CAS: |
1016642-07-1 |
Synonyms: |
4-thiazolylboronic acid; 1,3-thiazol-4-ylboronic acid |
IUPAC Name: | 1,3-thiazol-4-ylboronic acid |
Description: | 4-Thiazoleboronic Acid (CAS# 1016642-07-1) is a useful research chemical. |
Molecular Weight: | 128.95 |
Molecular Formula: | C3H4NO2SB |
Canonical SMILES: | B(C1=CSC=N1)(O)O |
InChI: | InChI=1S/C3H4BNO2S/c6-4(7)3-1-8-2-5-3/h1-2,6-7H |
InChI Key: | WSTDOIHBEOVTHX-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 ℃ |
MDL: | MFCD09879002 |
LogP: | -1.17710 |
GHS Hazard Statement: | H302 (33.33%): 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 |
CN-111440162-A | Thiazole dihydronaphthalene derivative and application thereof in metabolic diseases | 20200401 |
US-2021078994-A1 | MTA-Cooperative PRMT5 Inhibitors | 20190912 |
US-2021079003-A1 | MTA-Cooperative PRMT5 Inhibitors | 20190912 |
WO-2021050915-A1 | Mta-cooperative prmt5 inhibitors | 20190912 |
CN-113271946-A | Functionalized heterocyclic compounds as antiviral agents | 20181121 |
Complexity: | 81.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 129.0055797 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 129.0055797 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 81.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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