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Methyl 2-Amino-5-chlorothiophene-3-carboxylate

Methyl 2-Amino-5-chlorothiophene-3-carboxylate - CAS 55503-06-5

Catalog:	BB029065
Product Name:	Methyl 2-Amino-5-chlorothiophene-3-carboxylate
CAS:	55503-06-5
Synonyms:	2-amino-5-chloro-3-thiophenecarboxylic acid methyl ester; methyl 2-amino-5-chlorothiophene-3-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-amino-5-chlorothiophene-3-carboxylate
Description:	Methyl 2-Amino-5-chlorothiophene-3-carboxylate (CAS# 55503-06-5 ) is a useful research chemical.
Molecular Weight:	191.64
Molecular Formula:	C6H6ClNO2S
Canonical SMILES:	COC(=O)C1=C(SC(=C1)Cl)N
InChI:	InChI=1S/C6H6ClNO2S/c1-10-6(9)3-2-4(7)11-5(3)8/h2H,8H2,1H3
InChI Key:	NPMOAQRKBHOHII-UHFFFAOYSA-N
Appearance:	Solid
LogP:	2.35150

Publication Number	Title	Priority Date
CN-112661754-A	Polycyclic compound for inhibiting RNA helicase DHX33	20201230
EP-3152207-A1	Pyridopyrimidinedione derivatives	20140603
EP-3152207-B1	Pyridopyrimidinedione derivatives as suppressors of non-sens mutations	20140603
JP-2017516829-A	Pyridopyrimidinedione derivatives	20140603
JP-6526064-B2	Pyridopyrimidinedione derivatives	20140603

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Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.9807773
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	190.9807773
Rotatable Bond Count:	2
Topological Polar Surface Area:	80.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6