4,4-Dimethyl-2-cyclohexen-1-one - CAS 1073-13-8

Catalog:	BB002048
Product Name:	4,4-Dimethyl-2-cyclohexen-1-one
CAS:	1073-13-8
Synonyms:	4,4-dimethylcyclohex-2-en-1-one

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	4,4-dimethylcyclohex-2-en-1-one
Description:	4,4-Dimethyl-2-cyclohexen-1-one (CAS# 1073-13-8) is a useful research chemical for organic synthesis and other chemical processes.
Molecular Weight:	124.18
Molecular Formula:	C8H12O
Canonical SMILES:	CC1(CCC(=O)C=C1)C
InChI:	InChI=1S/C8H12O/c1-8(2)5-3-7(9)4-6-8/h3,5H,4,6H2,1-2H3
InChI Key:	HAUNPYVLVAIUOO-UHFFFAOYSA-N
Boiling Point:	72-73.5 °C20 mmHg (lit.)
Purity:	95 %
Density:	0.944 g/mL at 25°C(lit.)
Appearance:	Clear dark brown liquid
MDL:	MFCD00009695
LogP:	1.93170

Publication Number	Title	Priority Date
WO-2020099886-A1	Lox inhibitors	20181116
CN-113365984-A	LOX inhibitors	20181116
EP-3880664-A1	Lox inhibitors	20181116
WO-2019073251-A1	INHIBITORS OF LYSYL OXIDASE	20171013
EP-3694857-A1	Lysyl oxidase inhibitors	20171013

PMID	Publication Date	Title	Journal
18095682	20080116	Origins of selectivity for the [2+2] cycloaddition of alpha,beta-unsaturated ketones within a porous self-assembled organic framework	Journal of the American Chemical Society
16381590	20060105	An enantioselective total synthesis of (+)-ricciocarpin A	Organic letters
16332083	20051214	Influence of tetrahydrofuran on reactivity, aggregation, and aggregate structure of dimethylcuprates in diethyl ether	Journal of the American Chemical Society

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

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Customers Also Viewed

[1271-47-2]
Ethynylferrocene
[3886-90-6]
N,N-dimethyloctadecanamide
[55408-10-1]
Ethyl Tetrazole-5-carboxylate
[55382-52-0]
Methyl Divarinolcarboxylate
[875573-66-3]
Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
[852913-16-7]
N-[3,5-Bis(trifluoromethyl)phenyl]-N-[(8a,9S)-6-methoxy-9-cinchonanyl]thiourea

INDUSTRY LEADERS TRUST OUR PRODUCTS

Phone

US & Canada (Toll free):

UK:

International:

E-mail & Fax

E-mail:

Fax:

Address

USA:

UK:

Our Products

Inquiry Basket

Loading ......

Delete selected Go to checkout

GHS Hazard Statement:	H227 (16.67%): Combustible liquid [Warning Flammable liquids]
Precautionary Statement:	P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	154
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	124.088815002
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	124.088815002
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8