CAS
948293-61-6 Purity
96%
948293-61-6 Purity
96%
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5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester
CAS
948293-72-9
Catalog Number
ACM948293729
Category
Other Products
Molecular Weight
284.14
Molecular Formula
C13H11Cl2NO2
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Specification
Synonyms
5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester, 948293-72-9, ETHYL 5,7-DICHLORO-2-METHYLQUINOLINE-3-CARBOXYLATE, AGN-PC-01A9NA, CTK8E5116, ZINC32099475, AB52174, KB-244255
IUPAC Name
ethyl 5,7-dichloro-2-methylquinoline-3-carboxylate
Canonical SMILES
CCOC(=O)C1=C(N=C2C=C(C=C(C2=C1)Cl)Cl)C
InChI Key
AYUXKFCXXXXIAD-UHFFFAOYSA-N
Boiling Point
369.9ºC at 760 mmHg
Flash Point
177.5ºC
Density
1.344g/cm³
Exact Mass
283.01700
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The molecular formula is C13H11Cl2NO2.
What is the molecular weight of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The molecular weight is 284.13 g/mol.
When was 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester created in PubChem?
It was created on 2007-11-13.
When was 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester last modified in PubChem?
It was last modified on 2023-12-30.
What is the IUPAC name of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The IUPAC name is ethyl 5,7-dichloro-2-methylquinoline-3-carboxylate.
What is the InChI of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The InChI is InChI=1S/C13H11Cl2NO2/c1-3-18-13(17)9-6-10-11(15)4-8(14)5-12(10)16-7(9)2/h4-6H,3H2,1-2H3.
What is the InChIKey of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The InChIKey is AYUXKFCXXXXIAD-UHFFFAOYSA-N.
What is the canonical SMILES of 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester?
The canonical SMILES is CCOC(=O)C1=C(N=C2C=C(C=C(C2=C1)Cl)Cl)C.
How many hydrogen bond acceptor counts does 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester have?
It has 3 hydrogen bond acceptor counts.
Is 5,7-Dichloro-2-methylquinoline-3-carboxylic acid ethyl ester a canonicalized compound?
Yes, it is a canonicalized compound.
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