4'-Bromo-2',5'-dimethoxyacetophenone - CAS 90841-64-8

Catalog:	BB039968
Product Name:	4'-Bromo-2',5'-dimethoxyacetophenone
CAS:	90841-64-8
Synonyms:	1-(4-bromo-2,5-dimethoxyphenyl)ethanone; 1-(4-bromo-2,5-dimethoxyphenyl)ethanone

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(4-bromo-2,5-dimethoxyphenyl)ethanone
Description:	4'-Bromo-2',5'-dimethoxyacetophenone (CAS# 90841-64-8 ) is a useful research chemical.
Molecular Weight:	259.10
Molecular Formula:	C10H11BrO3
Canonical SMILES:	CC(=O)C1=CC(=C(C=C1OC)Br)OC
InChI:	InChI=1S/C10H11BrO3/c1-6(12)7-4-10(14-3)8(11)5-9(7)13-2/h4-5H,1-3H3
InChI Key:	PXIBOMTVNQIFET-UHFFFAOYSA-N
LogP:	2.66890

Publication Number	Title	Priority Date
WO-2020163541-A1	Methods and compositions for modulating splicing	20190205
EP-3218375-A1	Substituted pyrrolopyrdines as inhibitors of bromodomain	20141110
JP-2017533248-A	Substituted pyrrolopyridines as inhibitors of bromodomains	20141110
JP-6669744-B2	Substituted pyrrolopyridines as inhibitors of bromodomains	20141110
US-10183009-B2	Therapeutic compounds and uses thereof	20141110

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

Complexity:	208
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	257.98916
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	257.98916
Rotatable Bond Count:	3
Topological Polar Surface Area:	35.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2