CAS
948289-50-7 Purity
96%
948289-50-7 Purity
96%
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6-Ethoxy-2-methylquinoline-3-carboxylic acid ethyl ester
CAS
948289-68-7
Catalog Number
ACM948289687
Category
Other Products
Molecular Weight
259.3
Molecular Formula
C15H17NO3
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Specification
Synonyms
ETHYL 6-ETHOXY-2-METHYLQUINOLINE-3-CARBOXYLATE, 6-Ethoxy-2-methylquinoline-3-carboxylic acid ethyl ester, 948289-68-7, AGN-PC-01A9P7, ZINC32099572, AB52332
IUPAC Name
ethyl 6-ethoxy-2-methylquinoline-3-carboxylate
Canonical SMILES
CCOC1=CC2=CC(=C(N=C2C=C1)C)C(=O)OCC
InChI Key
BWLLSERAFGSZFT-UHFFFAOYSA-N
Boiling Point
362.4ºC at 760 mmHg
Flash Point
172.9ºC
Density
1.137g/cm³
Exact Mass
259.12100
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The molecular formula is C15H17NO3.
What is the molecular weight of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The molecular weight is 259.30 g/mol.
What is the IUPAC name of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The IUPAC name is ethyl 6-ethoxy-2-methylquinoline-3-carboxylate.
What is the InChIKey of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The InChIKey is BWLLSERAFGSZFT-UHFFFAOYSA-N.
How many hydrogen bond donor counts does ethyl 6-ethoxy-2-methylquinoline-3-carboxylate have?
It has 0 hydrogen bond donor counts.
What is the topological polar surface area of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The topological polar surface area is 48.4 Ų.
How many rotatable bond counts does ethyl 6-ethoxy-2-methylquinoline-3-carboxylate have?
It has 5 rotatable bond counts.
Is ethyl 6-ethoxy-2-methylquinoline-3-carboxylate a canonical compound?
Yes, it is a canonical compound.
What is the XLogP3-AA value of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The XLogP3-AA value is 3.1.
What is the exact mass of ethyl 6-ethoxy-2-methylquinoline-3-carboxylate?
The exact mass is 259.12084340 g/mol.
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