1,4-Dioxaspiro[4.5]-7-decene-8-boronic Acid Pinacol Ester - CAS 680596-79-6
Catalog: |
BB033466 |
Product Name: |
1,4-Dioxaspiro[4.5]-7-decene-8-boronic Acid Pinacol Ester |
CAS: |
680596-79-6 |
Synonyms: |
2-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 1,4-Dioxaspiro[4.5]-7-decene-8-boronic Acid Pinacol Ester (CAS# 680596-79-6) is a useful research chemical. |
Molecular Weight: | 266.14 |
Molecular Formula: | C14H23O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CCC3(CC2)OCCO3 |
InChI: | InChI=1S/C14H23BO4/c1-12(2)13(3,4)19-15(18-12)11-5-7-14(8-6-11)16-9-10-17-14/h5H,6-10H2,1-4H3 |
InChI Key: | JCHWHOHZZYWUMP-UHFFFAOYSA-N |
Melting Point: | 68-73 °C |
Flash Point: | Not applicable |
Purity: | 97 % |
Appearance: | Solid |
Storage: | 2-8 °C |
MDL: | MFCD04115656 |
LogP: | 2.47120 |
GHS Hazard Statement: | H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021299128-A1 | Compounds for treating or inhibiting recurrence of acute myeloid leukemia | 20200316 |
WO-2021184154-A1 | Compounds for treating or inhibiting recurrence of acute myeloid leukemia | 20200316 |
CN-111217693-A | method for preparing a, β -unsaturated carboxylic acid by reacting alkenyl boron compound catalyzed by cuprous halide with carbon dioxide | 20200219 |
JP-2021109846-A | New amide derivative | 20200110 |
WO-2021105960-A1 | Substituted tricyclic compounds | 20191129 |
Complexity: | 380 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.1689394 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.1689394 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 36.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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