2-(Ethoxycarbonyl)cyclopropylboronic Acid Pinacol Ester - CAS 1215107-29-1
Catalog: |
BB005189 |
Product Name: |
2-(Ethoxycarbonyl)cyclopropylboronic Acid Pinacol Ester |
CAS: |
1215107-29-1 |
Synonyms: |
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-cyclopropanecarboxylic acid ethyl ester; ethyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate |
IUPAC Name: | ethyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate |
Description: | 2-(Ethoxycarbonyl)cyclopropylboronic Acid Pinacol Ester (CAS# 1215107-29-1 ) is a useful research chemical. |
Molecular Weight: | 240.10 |
Molecular Formula: | C12H21O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2CC2C(=O)OCC |
InChI: | InChI=1S/C12H21BO4/c1-6-15-10(14)8-7-9(8)13-16-11(2,3)12(4,5)17-13/h8-9H,6-7H2,1-5H3 |
InChI Key: | AAORUCVESAXSRS-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.03180 |
Publication Number | Title | Priority Date |
CA-2926830-A1 | Thiazolopyrimidinones as modulators of nmda receptor activity | 20131011 |
DK-3055315-T3 | Thiazolopyrimidinones as modulators of NMDA receptor activity | 20131011 |
EP-3055315-B1 | Thiazolopyrimidinones as modulators of nmda receptor activity | 20131011 |
EP-3415519-A1 | Thiazolopyrimidinones as modulators of nmda receptor activity | 20131011 |
US-10647731-B2 | Thiazolopyrimidinones and methods of use thereof | 20131011 |
Complexity: | 311 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.1532893 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.1532893 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 44.8 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
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