1-(2-Morpholinoethyl)pyrazole-4-boronic Acid Pinacol Ester - CAS 864754-18-7
Catalog: |
BB037949 |
Product Name: |
1-(2-Morpholinoethyl)pyrazole-4-boronic Acid Pinacol Ester |
CAS: |
864754-18-7 |
Synonyms: |
4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-pyrazolyl]ethyl]morpholine; 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethyl]morpholine |
IUPAC Name: | 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethyl]morpholine |
Description: | 1-(2-Morpholinoethyl)pyrazole-4-boronic Acid Pinacol Ester (CAS# 864754-18-7) is a useful research chemical. |
Molecular Weight: | 307.20 |
Molecular Formula: | C15H26N3O3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CCN3CCOCC3 |
InChI: | InChI=1S/C15H26BN3O3/c1-14(2)15(3,4)22-16(21-14)13-11-17-19(12-13)6-5-18-7-9-20-10-8-18/h11-12H,5-10H2,1-4H3 |
InChI Key: | FBAPTUAEBQMVEY-UHFFFAOYSA-N |
Boiling Point: | 440.6 °C at 760 mmHg |
Melting Point: | 89-94 °C |
Flash Point: | Not applicable |
Purity: | 97 % |
Density: | 1.15 g/cm3 |
MDL: | MFCD08062342 |
LogP: | 0.45240 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021214366-A1 | Bicyclic heterocycles as fgfr inhibitors | 20200115 |
US-2021171535-A1 | Tricyclic heterocycles as fgfr inhibitors | 20191204 |
WO-2021113479-A1 | Tricyclic heterocycles as fgfr inhibitors | 20191204 |
US-2021106588-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
WO-2021076602-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
Complexity: | 372 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 307.2067219 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 307.2067219 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 48.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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