3-Carbomethoxy-7-chloro-4-hydroxyquinoline-2-carbonyl chloride

HCID 21997680
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Basic information

Standard SMILES
COC(=O)c1c(C(=O)Cl)[nH]c2cc(Cl)ccc2c1=O
InChIKey
LYUVEFJSRUXCKH-UHFFFAOYSA-N
Molecular formula
C12H7Cl2NO4
Average molar mass
300.09 g/mol
Monoisotopic mass
298.9752131

Names & identifiers

Preferred name
3-Carbomethoxy-7-chloro-4-hydroxyquinoline-2-carbonyl chloride
IUPAC
methyl 2-carbonochloridoyl-7-chloro-4-oxo-1H-quinoline-3-carboxylate

Names & synonyms

SCHEMBL6230583SCHEMBL6231653LYUVEFJSRUXCKH-UHFFFAOYSA-Nmethyl 7-chloro-2-(chlorocarbonyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate179543-90-9DB-3083833-carbomethoxy-7-chloro-4-hydroxyquinoline-2-carbonyl chloride7-Chloro-3-methoxycarbonyl-4-oxo-1,4-dihydroquinoline-2-carbonyl chloride7-Chloro-2-chlorocarbonyl-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid Methyl Ester

Database identifiers

PubChem CID
21997680

Properties

Computed structural properties

XLogP
3
Topological polar surface area
72.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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