2,4-Dibromo-2,4-dimethyl-3-pentanone - CAS 17346-16-6

Catalog:	BB012923
Product Name:	2,4-Dibromo-2,4-dimethyl-3-pentanone
CAS:	17346-16-6
Synonyms:	2,4-dibromo-2,4-dimethylpentan-3-one

Technical Data

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Computed Properties

IUPAC Name:	2,4-dibromo-2,4-dimethylpentan-3-one
Description:	2,4-Dibromo-2,4-dimethyl-3-pentanone (CAS# 17346-16-6 ) is a useful research chemical.
Molecular Weight:	271.98
Molecular Formula:	C7H12Br2O
Canonical SMILES:	CC(C)(C(=O)C(C)(C)Br)Br
InChI:	InChI=1S/C7H12Br2O/c1-6(2,8)5(10)7(3,4)9/h1-4H3
InChI Key:	SWSOAIMZWLDPST-UHFFFAOYSA-N
Boiling Point:	89-91 ℃13 mmHg (lit.)
Purity:	95 %
Density:	1.61 g/mL at 25 ℃(lit.)
Appearance:	Clear colorless to amber liquid
Storage:	Flammables area
MDL:	MFCD00051923
LogP:	2.90250

Publication Number	Title	Priority Date
US-2020048347-A1	Bispecific antibodies	20160901
EP-3353157-A1	Far superior oxidation catalysts based on macrocyclic compounds	20150925
US-2018304247-A1	Far superior oxidation catalysts based on macrocyclic compounds	20150925
WO-2017053564-A1	Far superior oxidation catalysts based on macrocyclic compounds	20150925
US-10926248-B2	Far superior oxidation catalysts based on macrocyclic compounds	20150925

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Carbonyl Compounds

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Undecanoyl chloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[55441-25-3]
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[1431966-64-1]
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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

Complexity:	134
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	271.92344
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	269.92549
Rotatable Bond Count:	2
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7