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CAS Number: 42122-75-8
methyl 5-amino-2-chlorobenzoate

Structure

methyl 5-amino-2-chlorobenzoate
Name: methyl 5-amino-2-chlorobenzoate
Synonyms:
General Information
Product Number: 42122758

CAS Registry Number 42122-75-8
Name:
Benzoic acid, 5-​amino-​2-​chloro-​, methyl ester
5-Amino-2-chlorobenzoic acid methyl ester
Methyl 2-chloro-5-aminobenzoate
Methyl 3-amino-6-chlorobenzoate
Methyl 5-amino-2-chlorobenzoate

 

Chemical Formula: C8H8ClNO2
Exact Mass: 185.02
Molecular Weight: 185.61
m/z: 185.02 (100.0%), 187.02 (32.0%), 186.03 (8.8%), 188.02 (2.9%)

 

InChI:InChI=1S/C8H8ClNO2/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4H,10H2,1H3

InChI Key:LBNPBOFVHYOPIB-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=C(C=CC(=C1)N)Cl

 

Thermal Properties Value Condition Note
Melting Point 68-70 °C   (2)CAS

Specification

98%

References

(2) Shankaraiah, Nagula; Synthesis 2009, (13), P2163-2170 CAPLUS

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