1-Isopropylpyrazole-5-boronic Acid Pinacol Ester - CAS 1282518-60-8
Catalog: |
BB006886 |
Product Name: |
1-Isopropylpyrazole-5-boronic Acid Pinacol Ester |
CAS: |
1282518-60-8 |
Synonyms: |
1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole; 1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole |
IUPAC Name: | 1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole |
Description: | 1-Isopropylpyrazole-5-boronic Acid Pinacol Ester (CAS# 1282518-60-8) is a useful research chemical. |
Molecular Weight: | 236.12 |
Molecular Formula: | C12H21N2O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=NN2C(C)C |
InChI: | InChI=1S/C12H21BN2O2/c1-9(2)15-10(7-8-14-15)13-16-11(3,4)12(5,6)17-13/h7-9H,1-6H3 |
InChI Key: | ZKZJXVGTTZXHGX-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
MDL: | MFCD17167306 |
LogP: | 1.76320 |
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-2021143729-A1 | Compound, composition and functional molecule with multi-target inhibiting effect and use thereof | 20200115 |
CN-112851668-A | ATR inhibitor and application thereof in medicine | 20191127 |
WO-2021097054-A1 | 6-membered heteroarylaminosulfonamides for treating diseases and conditions mediated by deficient cftr activity | 20191112 |
WO-2020259601-A1 | Substituted fused heteroaromatic bicyclic compounds as kinase inhibitors and the use thereof | 20190628 |
WO-2020127924-A1 | Process and intermediates for the preparation of voxelotor | 20181221 |
Complexity: | 278 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.1696081 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.1696081 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 36.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Boronic Acids and Esters
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS