4-Chlorobutyraldehyde Diethyl Acetal - CAS 6139-83-9

Catalog:	BB031088
Product Name:	4-Chlorobutyraldehyde Diethyl Acetal
CAS:	6139-83-9
Synonyms:	4-chloro-1,1-diethoxybutane; 4-chloro-1,1-diethoxybutane

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-1,1-diethoxybutane
Description:	4-Chlorobutyraldehyde Diethyl Acetal (CAS# 6139-83-9) is a compound useful in organic synthesis. It is used in preparation of Fendiline derivatives as KRAS modulators.
Molecular Weight:	180.67
Molecular Formula:	C8H17ClO2
Canonical SMILES:	CCOC(CCCCl)OCC
InChI:	InChI=1S/C8H17ClO2/c1-3-10-8(11-4-2)6-5-7-9/h8H,3-7H2,1-2H3
InChI Key:	JGGRHRMHOUWCDX-UHFFFAOYSA-N
Boiling Point:	208.6 ℃
Density:	0.976 g/cm³
MDL:	MFCD00671476
LogP:	2.40450

Publication Number	Title	Priority Date
WO-2021050612-A1	Compositions and methods for the treatment of respiratory syncytial virus	20190909
WO-2020252396-A1	Compositions and methods for the treatment of respiratory syncytial virus	20190613
WO-2020181143-A1	Fendiline derivatives	20190305
EP-3487854-A1	The method for manufacture of brexpiprazole, intermediates used in this method, and the method for manufacture thereof	20160719
WO-2018015354-A1	The method for manufacture of brexpiprazole, intermediates used in this method, and the method for manufacture thereof	20160719

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

[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Customers Also Viewed

[14245-62-6]
Isopropyl ethanesulfonate
[1184173-73-6]
MK-8353
[16208-48-3]
Ethanesulfonic acid, 2,2'-trithiodi-, disodium salt
[10128-55-9]
N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide
[4294-16-0]
N6-Benzyl Adenosine
[72607-53-5]
N-(3-Aminopropyl)methacrylamide Hydrochloride

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:	H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, 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:	72.5
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.0917075
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	180.0917075
Rotatable Bond Count:	7
Topological Polar Surface Area:	18.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1