CAS 2973-58-2 | Benzaldehyde, 2-bromo-3-hydroxy-4-methoxy- | CAS Number 2973-58-2

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2973-58-2 | Benzaldehyde, 2-bromo-3-hydroxy-4-methoxy-

CAS No: 2973-58-2 Catalog No: AG002Z8Y MDL No:MFCD02380230

Product Description

Catalog Number:

AG002Z8Y

Chemical Name:

Benzaldehyde, 2-bromo-3-hydroxy-4-methoxy-

CAS Number:

2973-58-2

Molecular Formula:

C8H7BrO3

Molecular Weight:

231.0434

MDL Number:

MFCD02380230

IUPAC Name:

2-bromo-3-hydroxy-4-methoxybenzaldehyde

InChI:

InChI=1S/C8H7BrO3/c1-12-6-3-2-5(4-10)7(9)8(6)11/h2-4,11H,1H3

InChI Key:

QPDFBPIHEDAUKK-UHFFFAOYSA-N

SMILES:

COc1ccc(c(c1O)Br)C=O

Properties

Complexity:

162

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.958g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

231.045g/mol

Monoisotopic Mass:

229.958g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5

Literature

Title	Journal
Proteomic profiling revealed the functional networks associated with mitotic catastrophe of HepG2 hepatoma cells induced by 6-bromine-5-hydroxy-4-methoxybenzaldehyde.	Toxicology and applied pharmacology 20110501
Total synthesis of pareitropone via radical anion coupling.	Organic letters 20100903
Induction of apoptosis and autophagic cell death by the vanillin derivative 6-bromine-5-hydroxy-4-methoxybenzaldehyde is accompanied by the cleavage of DNA-PKcs and rapid destruction of c-Myc oncoprotein in HepG2 cells.	Cancer letters 20070718