Ethyl 2-(4-Oxocyclohexyl)acetate - CAS 58012-34-3

Name: Ethyl 2-(4-Oxocyclohexyl)acetate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB029898
Product Name:	Ethyl 2-(4-Oxocyclohexyl)acetate
CAS:	58012-34-3
Synonyms:	2-(4-oxocyclohexyl)acetic acid ethyl ester; ethyl 2-(4-oxocyclohexyl)acetate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 2-(4-oxocyclohexyl)acetate
Description:	Ethyl 2-(4-Oxocyclohexyl)acetate (CAS# 58012-34-3) is a useful research chemical.
Molecular Weight:	184.23
Molecular Formula:	C10H16O3
Canonical SMILES:	CCOC(=O)CC1CCC(=O)CC1
InChI:	InChI=1S/C10H16O3/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h8H,2-7H2,1H3
InChI Key:	XHNJFNLTFMAPQB-UHFFFAOYSA-N
Boiling Point:	265.5 °C at 760 mmHg
Density:	1.04 g/cm³
MDL:	MFCD11045783
LogP:	1.69890

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]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

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

Publication Number	Title	Priority Date
WO-2021204626-A1	Aryl and heteroaryl-carboxamide substituted heteroaryl compounds as tyk2 inhibitors	20200406
WO-2020233676-A1	Amide-substituted imidazo compounds as selective inhibitors of indoleamine 2, 3-dioxygenases	20190522
WO-2020233677-A1	Process for preparing amide-substituted imidazo compounds	20190522
WO-2019196780-A1	Novel indoleamine 2,3-dioxygenase inhibitor, preparation method therefor, and use thereof	20180409
CN-112004790-A	Novel indoleamine 2, 3-dioxygenase inhibitor and preparation method and application thereof	20180409

Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.109944368
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.109944368
Rotatable Bond Count:	4
Topological Polar Surface Area:	43.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8