trans-2-Methyl-cyclopropyl Boronic Acid Pinacol Ester - CAS 1350713-20-0
Catalog: |
BB059203 |
Product Name: |
trans-2-Methyl-cyclopropyl Boronic Acid Pinacol Ester |
CAS: |
1350713-20-0 |
Synonyms: |
rel-4,4,5,5-Tetramethyl-2-[(1R,2R)-2-methylcyclopropyl]-1,3,2-dioxaborolane; 4,4,5,5-Tetramethyl-2-((trans)-2-methyl-cyclopropyl)[1,3,2]dioxaborolane |
IUPAC Name: | 4,4,5,5-tetramethyl-2-[(1R,2R)-2-methylcyclopropyl]-1,3,2-dioxaborolane |
Description: | trans-2-Methyl-cyclopropyl Boronic Acid Pinacol Ester can be synthesized from trans-1-Propen-1-ylboronic Acid (7547-97-9). |
Molecular Weight: | 182.07 |
Molecular Formula: | C10H19BO2 |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2CC2C |
InChI: | InChI=1S/C10H19BO2/c1-7-6-8(7)11-12-9(2,3)10(4,5)13-11/h7-8H,6H2,1-5H3/t7-,8-/m1/s1 |
InChI Key: | TUXCUWZCFQDMLZ-HTQZYQBOSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless Oil |
Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021195367-A | Cyclopropyldihydroquinoline sulfonamide compound | 20200610 |
US-2021387977-A1 | Cyclopropyl dihydroquinoline sulfonamide compounds | 20200610 |
WO-2021252818-A1 | Cyclopropyl dihydroquinoline sulfonamide compounds | 20200610 |
CN-111201229-A | Bicyclic compounds useful as RIP1 kinase inhibitors | 20171011 |
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JP-2020536915-A | Bicyclic compounds for use as RIP1 kinase inhibitors | 20171011 |
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Complexity: | 209 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.14781 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.14781 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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