6-Bromo-3-formylchromone - CAS 52817-12-6

Name: 6-Bromo-3-formylchromone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB027956
Product Name:	6-Bromo-3-formylchromone
CAS:	52817-12-6
Synonyms:	6-bromo-4-oxochromene-3-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	6-bromo-4-oxochromene-3-carbaldehyde
Description:	6-Bromo-3-formylchromone (CAS# 52817-12-6) is a useful research chemical.
Molecular Weight:	253.05
Molecular Formula:	C10H5BrO3
Canonical SMILES:	C1=CC2=C(C=C1Br)C(=O)C(=CO2)C=O
InChI:	InChI=1S/C10H5BrO3/c11-7-1-2-9-8(3-7)10(13)6(4-12)5-14-9/h1-5H
InChI Key:	PCEZXSJBHMOQFT-UHFFFAOYSA-N
Boiling Point:	365.7 °C at 760 mmHg
Density:	1.835 g/cm³
Appearance:	Yellow powder
MDL:	MFCD00191849
LogP:	2.36800

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[17746-05-3]C11H21ClO
Undecanoyl chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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-110128444-B	P-nitrophenyl substituted chromone structure-containing spiro [ indazole-isoxazole ] derivative, and preparation method and application thereof	20190619
CN-110128445-B	P-chlorophenyl substituted chromone structure-containing spiro [ indazole-isoxazole ] derivative, and preparation method and application thereof	20190619
CN-110128447-B	P-methylphenyl substituted chromone structure-containing spiro [ indazole-isoxazole ] derivative, and preparation method and application thereof	20190619
CN-110156812-B	Spiro [ indazole-isoxazole ] derivative containing chromone structure, and preparation method and application thereof	20190619
CN-110183467-B	P-methoxyphenyl substituted chromone structure-containing spiro [ indazole-isoxazole ] derivative, and preparation method and application thereof	20190619

PMID	Publication Date	Title	Journal
18019419	20070901	Biological activity of 3-formylchromones and related compounds	In vivo (Athens, Greece)
12852966	20030804	Formylchromone derivatives as a novel class of protein tyrosine phosphatase 1B inhibitors	Bioorganic & medicinal chemistry letters

Complexity:	298
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	251.94221
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	251.94221
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9