4-Bromo-2H-chromen-2-one - CAS 938-40-9
Catalog: |
BB041096 |
Product Name: |
4-Bromo-2H-chromen-2-one |
CAS: |
938-40-9 |
Synonyms: |
4-bromo-1-benzopyran-2-one; 4-bromochromen-2-one |
IUPAC Name: | 4-bromochromen-2-one |
Description: | 4-Bromo-2H-chromen-2-one (CAS# 938-40-9 ) is a useful research chemical. |
Molecular Weight: | 225.04 |
Molecular Formula: | C9H5BrO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=CC(=O)O2)Br |
InChI: | InChI=1S/C9H5BrO2/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5H |
InChI Key: | CSMSWYXPXRIHBY-UHFFFAOYSA-N |
LogP: | 2.55550 |
Publication Number | Title | Priority Date |
US-2021147386-A1 | Pyrrolidine and piperidine compounds | 20191106 |
WO-2021090245-A1 | Pyrrolidine and piperidine compounds | 20191106 |
CN-112574159-A | Coumarin derivatives and analogs, and preparation method and application thereof | 20190929 |
WO-2020028396-A1 | Chirality sensing with molecular click chemistry probes | 20180730 |
AU-2016327715-A1 | 4-substitued coumarin derivative, and preparation method and use thereof | 20150924 |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.94729 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.94729 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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Related Functional Groups
Benzopyrans
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