Ethyl N-(2.3-Dichloro-6-Nitrobenzyl)Glycine Hydrochloride

Chemistry, 2 End Use API, 2 Related Intermediates

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Ethyl N-(2.3-Dichloro-6-Nitrobenzyl)Glycine Hydrochloride

Also known as: 70380-50-6, Ethyl 2-[(2,3-dichloro-6-nitrophenyl)methylamino]acetate;hydrochloride, Glycine, n-[(2,3-dichloro-6-nitrophenyl)methyl]-, ethyl ester, hydrochloride (1:1), Schembl273187

Molecular Formula

C₁₁H₁₃Cl₃N₂O₄

Molecular Weight

343.6 g/mol

InChI Key

OUUNBAYMSDWITP-UHFFFAOYSA-N

1 2D Structure

Ethyl N-(2.3-Dichloro-6-Nitrobenzyl)Glycine Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 2-[(2,3-dichloro-6-nitrophenyl)methylamino]acetate;hydrochloride

2.1.2 InChI

InChI=1S/C11H12Cl2N2O4.ClH/c1-2-19-10(16)6-14-5-7-9(15(17)18)4-3-8(12)11(7)13;/h3-4,14H,2,5-6H2,1H3;1H

2.1.3 InChI Key

OUUNBAYMSDWITP-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)CNCC1=C(C=CC(=C1Cl)Cl)[N+](=O)[O-].Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 70380-50-6

2. Ethyl 2-[(2,3-dichloro-6-nitrophenyl)methylamino]acetate;hydrochloride

3. Glycine, N-[(2,3-dichloro-6-nitrophenyl)methyl]-, Ethyl Ester, Hydrochloride (1:1)

4. Schembl273187

2.3 Create Date

2008-10-27

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₃Cl₃N₂O₄
Molecular Weight	343.6 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	341.994090 g/mol
Monoisotopic Mass	341.994090 g/mol
Topological Polar Surface Area	84.2 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	324
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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Ethyl N-(2,3-Dichloro-6-Nitrobenzyl)Glycine

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CAS Number

70380-50-6

End Use API

Anugraha Chemicals, a company engaged in Contract Manufacturing and Manufacturing of APIs, Intermediates ...

Anugraha Chemicals, a company engaged in Contract Manufacturing and Manufacturing of APIs, Intermediates and Fine Chemicals, was established in 1991 and has a rich experience of over two and a half decades in the Pharmaceutical arena. The unit is located at KSSIDC Industrial Estate, Doddaballapur, Bangalore, India, about 25kms drive from Kempegowda International Airport. The facility is currently GMP certified and is in compliance with ISO 9001-2008 QMS, 14001-2004 EMS, 18001-2007 OHSAS and HALAL. We are working on upgrading the facility to comply with WHO-GMP. The facility houses a well equipped R&D and Pilot Scale Lab designed to manufact

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