Ethyl 3-Isoquinolinecarboxylate - CAS 50458-79-2

Catalog:	BB027064
Product Name:	Ethyl 3-Isoquinolinecarboxylate
CAS:	50458-79-2
Synonyms:	3-isoquinolinecarboxylic acid ethyl ester; ethyl isoquinoline-3-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl isoquinoline-3-carboxylate
Description:	Ethyl 3-Isoquinolinecarboxylate (CAS# 50458-79-2) is a useful research chemical.
Molecular Weight:	201.22
Molecular Formula:	C12H11NO2
Canonical SMILES:	CCOC(=O)C1=CC2=CC=CC=C2C=N1
InChI:	InChI=1S/C12H11NO2/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11/h3-8H,2H2,1H3
InChI Key:	IFSCYCNNAIADLI-UHFFFAOYSA-N
Boiling Point:	355.52 °C at 760 mmHg
Density:	1.176 g/cm³
MDL:	MFCD10566077
LogP:	2.41150

Publication Number	Title	Priority Date
CN-111943946-A	Dihydroquinazinone carboxylic acid compound containing nitrogen heterocyclic segment and application thereof	20200819
CN-111410653-A	Dihydroisoquinoline compound	20190108
WO-2020143604-A1	Dihydroisoquinoline compound	20190108
KR-20210111807-A	Dihydroisoquinoline compounds	20190108
CN-111217811-A	Fused tricyclic compound and application thereof in medicines	20181126

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
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[438616-66-1]
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[17432-37-0]
2,3,5,6-Tetramethylbenzaldehyde

Customers Also Viewed

[6315-52-2]
Ethylene di(p-toluenesulfonate)
[582-16-1]
2,7-Dimethylnaphthalene
[75726-96-4]
2-Bromo-N-isopropylacetamide
[471915-89-6]
N-(3,4-Dihydroxyphenethyl)methacrylamide
[55382-52-0]
Methyl Divarinolcarboxylate
[1984-15-2]
Methylenediphosphonic acid

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:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	230
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	201.078978594
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	201.078978594
Rotatable Bond Count:	3
Topological Polar Surface Area:	39.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7