Methyl 4-(3-thienyl)benzoate - CAS 20608-91-7

Catalog:	BB016101
Product Name:	Methyl 4-(3-thienyl)benzoate
CAS:	20608-91-7
Synonyms:	methyl 4-thiophen-3-ylbenzoate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 4-thiophen-3-ylbenzoate
Description:	Methyl 4-(3-thienyl)benzoate (CAS# 20608-91-7) is a useful research chemical.
Molecular Weight:	218.27
Molecular Formula:	C12H10O2S
Canonical SMILES:	COC(=O)C1=CC=C(C=C1)C2=CSC=C2
InChI:	InChI=1S/C12H10O2S/c1-14-12(13)10-4-2-9(3-5-10)11-6-7-15-8-11/h2-8H,1H3
InChI Key:	NTBKCEONBLOPPY-UHFFFAOYSA-N
Boiling Point:	310.8 °C at 760 mmHg
Density:	1.198 g/cm³
Solubility:	Insoluble in water
Appearance:	White crystalline powder
MDL:	MFCD05863312
LogP:	3.20170

Publication Number	Title	Priority Date
TW-201704203-A	Antitumor compound targeting IDH2 mutation and method of use thereof	20150730
WO-2017016523-A1	Antitumor compound targeting idh2 mutation and method of use thereof	20150730
WO-2009113314-A1	Gas molecule-adsorbable material, sensor element, sensor, and method for production of sensor element	20080313
AU-721952-B2	Inhibitors of farnesyl-protein transferase	19960403
CA-2249645-A1	Inhibitors of farnesyl-protein transferase	19960403

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

Thiophenes

[79485-96-4]
3-Bromo-2,4-dimethylthiophene
[38401-73-9]
5-(3-Nitrophenyl)-2-thiophenecarbaldehyde
[851176-37-9]
2-Morpholino-2-(2-thienyl)ethylamine
[610259-52-4]
Ethyl 1-(thiophen-2-ylsulfonyl)piperidine-3-carboxylate
[438220-53-2]
Ethyl 2-amino-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
[350989-99-0]
Ethyl 2-amino-4-(4-ethylphenyl)thiophene-3-carboxylate

Customers Also Viewed

[119-24-4]
Folic Acid EP Impurity D (Methotrexate EP Impurity D)
[3735-92-0]
Methyl dimethyldithiocarbamate
[3821-81-6]
3-Amino-2-fluoropropionic acid
[1808-26-0]
Ethyl arachidonate
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[92-06-8]
m-Terphenyl

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:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501
Signal Word:	Danger

Complexity:	222
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	218.04015073
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	218.04015073
Rotatable Bond Count:	3
Topological Polar Surface Area:	54.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1