Cube Research Laboratories

CAS 183288-42-8

Chemistry, 1 End Use API, 22 Related Intermediates

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Also known as: 183288-42-8, Ethyl 5-aminobenzofuran-2-carboxylate hcl, Ethyl 5-amino-1-benzofuran-2-carboxylate hydrochloride, Ethyl 5-amino-1-benzofuran-2-carboxylate;hydrochloride, 2-benzofurancarboxylic acid, 5-amino-, ethyl ester, hydrochloride (1:1), Ethyl 5-amino-1-benzofuran-2-carboxylate hcl

Molecular Formula

C₁₁H₁₂ClNO₃

Molecular Weight

241.67 g/mol

InChI Key

XGGIUALENXNONX-UHFFFAOYSA-N

1 2D Structure

CAS 183288-42-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 5-amino-1-benzofuran-2-carboxylate;hydrochloride

2.1.2 InChI

InChI=1S/C11H11NO3.ClH/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10;/h3-6H,2,12H2,1H3;1H

2.1.3 InChI Key

XGGIUALENXNONX-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)N.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 183288-42-8

2. Ethyl 5-aminobenzofuran-2-carboxylate Hcl

3. Ethyl 5-amino-1-benzofuran-2-carboxylate Hydrochloride

4. Ethyl 5-amino-1-benzofuran-2-carboxylate;hydrochloride

5. 2-benzofurancarboxylic Acid, 5-amino-, Ethyl Ester, Hydrochloride (1:1)

6. Ethyl 5-amino-1-benzofuran-2-carboxylate Hcl

7. Cs-m2450

8. Cl4582

9. Mfcd22574189

10. Sb21640

11. As-45981

12. Ethyl5-aminobenzofuran-2-carboxylatehydrochloride

13. Ethyl 5-aminobenzofuran-2-carboxylate (hydrochloride)

2.3 Create Date

2013-10-25

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₂ClNO₃
Molecular Weight	241.67 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	241.0505709 g/mol
Monoisotopic Mass	241.0505709 g/mol
Topological Polar Surface Area	65.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	244
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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CAS Number

163521-09-3

End Use API

Vilazodone

About the Company

CRL’ is a nascent yet dynamically growing centre for metallurgical operation, Process synthesis, Resear...

CRL’ is a nascent yet dynamically growing centre for metallurgical operation, Process synthesis, Research & Development and Manufacturing hub. We form a part of the group company specializing in API sales and marketing and analytical services. At Cube Research Laboratories our array of activities includes Metal recovery, separation, Manufacturing of Intermediates, Synthesis of Impurities, Key raw materials, catalyst synthesis and Specialty chemicals. We offer intermediates and impurities from a standard list as well as custom synthesize them for our clients, maintaining confidentiality.

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