1,3-Diacetylbenzene - CAS 6781-42-6

Name: 1,3-Diacetylbenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB033404
Product Name:	1,3-Diacetylbenzene
CAS:	6781-42-6
Synonyms:	1-(3-acetylphenyl)ethanone

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-(3-acetylphenyl)ethanone
Description:	1,3-Diacetylbenzene (CAS# 6781-42-6) is a useful research chemical.
Molecular Weight:	162.19
Molecular Formula:	C10H10O2
Canonical SMILES:	CC(=O)C1=CC(=CC=C1)C(=O)C
InChI:	InChI=1S/C10H10O2/c1-7(11)9-4-3-5-10(6-9)8(2)12/h3-6H,1-2H3
InChI Key:	VCHOFVSNWYPAEF-UHFFFAOYSA-N
Boiling Point:	150-155 °C (15 torr)
Density:	1.063 g/cm³
Appearance:	Clear slightly yellow liquid after melting
MDL:	MFCD00008740
LogP:	2.09180

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Carbonyl Compounds

[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Publication Number	Title	Priority Date
CN-113292404-A	Process for preparing 1, 3-diacyl benzene	20210624
CN-113461912-A	Polycyclic aromatic skeleton polymers, process for their preparation and their use	20210528
CN-112079995-A	Transition metal modified pyridine nitrogen-based conjugated microporous polymer composite photocatalyst	20200821
JP-2021155351-A	Crystals of phenanthroline derivatives and methods for producing them	20200326
WO-2021193818-A1	Crystal of phenanthroline derivative, method for producing same and light emitting element using same	20200326

PMID	Publication Date	Title	Journal
23007703	20121121	Metal self-recognition: a pathway to control the formation of dihelicates and mesocates	Dalton transactions (Cambridge, England : 2003)
17577667	20071201	Axonopathy-inducing 1,2-diacetylbenzene forms adducts with motor and cytoskeletal proteins required for axonal transport	Neurochemical research
12396048	20021001	Synthesis and spectroscopic characterization of cationic mononuclear oxovanadium(IV) complexes with tetradentate Schiff bases as ligands	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
12217642	20020815	Amino acid and protein targets of 1,2-diacetylbenzene, a potent aromatic gamma-diketone that induces proximal neurofilamentous axonopathy	Toxicology and applied pharmacology
9767632	19981008	Geometrically and conformationally restrained cinnamoyl compounds as inhibitors of HIV-1 integrase: synthesis, biological evaluation, and molecular modeling	Journal of medicinal chemistry

Complexity:	176
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.068079557
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	162.068079557
Rotatable Bond Count:	2
Topological Polar Surface Area:	34.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4