N-(2-Bromoethyl)phthalimide - CAS 574-98-1
Catalog: |
BB029723 |
Product Name: |
N-(2-Bromoethyl)phthalimide |
CAS: |
574-98-1 |
Synonyms: |
2-(2-bromoethyl)isoindole-1,3-dione |
IUPAC Name: | 2-(2-bromoethyl)isoindole-1,3-dione |
Description: | N-(2-Bromoethyl)phthalimide (CAS# 574-98-1) is a building block that has been used as a reactant for the preparation of β-Cyclodextrin derivatives. |
Molecular Weight: | 254.08 |
Molecular Formula: | C10H8BrNO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=O)N(C2=O)CCBr |
InChI: | InChI=1S/C10H8BrNO2/c11-5-6-12-9(13)7-3-1-2-4-8(7)10(12)14/h1-4H,5-6H2 |
InChI Key: | CHZXTOCAICMPQR-UHFFFAOYSA-N |
Boiling Point: | 318 °C |
Density: | 1.657 g/cm3 |
MDL: | MFCD00005902 |
LogP: | 1.61540 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113185442-A | Pramipexole hydrate crystal and preparation method thereof | 20210511 |
CN-113295667-A | Detect Cu simultaneously+And Cu2+Surface-enhanced Raman spectrum probe and preparation method and application thereof | 20210430 |
CN-112251820-A | VEGFR-2 inhibitor screening method, VEGFR-2 inhibitor and antitumor drug | 20201023 |
CN-111925320-A | Method for efficiently synthesizing polysubstituted 2-pyridone compound | 20200812 |
WO-2021207291-A1 | Compounds and uses thereof | 20200406 |
PMID | Publication Date | Title | Journal |
24378967 | 20131227 | Synthesis of novel 2-(substituted amino)alkylthiopyrimidin-4(3H)-ones as potential antimicrobial agents | Molecules (Basel, Switzerland) |
22219876 | 20111101 | 2-(2-Bromo-eth-yl)isoindoline-1,3-dione | Acta crystallographica. Section E, Structure reports online |
19734050 | 20091001 | Identification and characterization of novel sirtuin inhibitor scaffolds | Bioorganic & medicinal chemistry |
Complexity: | 243 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.97384 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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