Cas no 84102-77-2 (Methyl 5-cyanobenzofuran-2-carboxylate)

Methyl 5-cyanobenzofuran-2-carboxylate is a heterocyclic organic compound featuring a benzofuran core substituted with a cyano group at the 5-position and a methyl ester at the 2-position. This structure imparts versatility in synthetic applications, particularly as an intermediate in pharmaceuticals, agrochemicals, and materials science. The electron-withdrawing cyano and ester groups enhance reactivity, facilitating further functionalization via nucleophilic substitution or cross-coupling reactions. Its high purity and stability under standard conditions make it suitable for precision synthesis. The compound’s rigid benzofuran scaffold also contributes to its utility in designing bioactive molecules with potential pharmacological properties. Proper handling and storage are recommended to maintain integrity.

Methyl 5-cyanobenzofuran-2-carboxylate structure

84102-77-2 structure

Product Name:Methyl 5-cyanobenzofuran-2-carboxylate

CAS No:84102-77-2

MF:C₁₁H₇NO₃

MW:201.178182840347

CID:828095

PubChem ID:10584213

Update Time:2025-06-07

Methyl 5-cyanobenzofuran-2-carboxylate Chemical and Physical Properties

Names and Identifiers

- Methyl 5-cyanobenzofuran-2-carboxylate
- Methyl 5-cyano-1-benzofuran-2-carboxylate
- A904324
- SCHEMBL9231951
- AC-27187
- AKOS002666486
- Methyl5-cyanobenzofuran-2-carboxylate
- DTXSID10442073
- FT-0734660
- 84102-77-2
- DA-17075
- MDL： MFCD08753860
- Inchi： 1S/C11H7NO3/c1-14-11(13)10-5-8-4-7(6-12)2-3-9(8)15-10/h2-5H,1H3
- InChI Key： JHRYAFRCGFDTSK-UHFFFAOYSA-N
- SMILES： O1C(C(=O)OC)=CC2C=C(C#N)C=CC1=2

Computed Properties

Exact Mass: 201.042593085g/mol
Monoisotopic Mass: 201.042593085g/mol
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 4
Heavy Atom Count: 15
Rotatable Bond Count: 2
Complexity: 306
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 2.2
Topological Polar Surface Area: 63.2?2

Methyl 5-cyanobenzofuran-2-carboxylate Pricemore >>

Related Categories	No.	Product Name	Cas No.	Purity	Specification	Price	update time
Chemenu	CM153809-1g	methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	95%	1g	$561	2021-06-09
Chemenu	CM153809-5g	methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	95%	5g	$1683	2021-06-09
Alichem	A019098426-1g	Methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	95%	1g	$657.28	2023-08-31
Alichem	A019098426-5g	Methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	95%	5g	$2008.70	2023-08-31
Chemenu	CM153809-1g	methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	95%	1g	$***	2023-05-29
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.	1743424-1g	Methyl 5-cyanobenzofuran-2-carboxylate	84102-77-2	98%	1g	￥6772.00	2024-07-28