CAS
948290-59-3 Purity
96%
948290-59-3 Purity
96%
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7-Ethylquinoline-3-carboxylic acid
CAS
948290-70-8
Catalog Number
ACM948290708
Category
Other Products
Molecular Weight
201.22
Molecular Formula
C12H11NO2
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Specification
Synonyms
7-Ethylquinoline-3-carboxylic acid, 948290-70-8, AGN-PC-01A9Q7, CTK8E5524, AB52405, KB-249789
IUPAC Name
7-ethylquinoline-3-carboxylic acid
Canonical SMILES
CCC1=CC2=NC=C(C=C2C=C1)C(=O)O
InChI Key
WJMGUVPYUJSNMI-UHFFFAOYSA-N
Boiling Point
369.5ºC at 760 mmHg
Flash Point
177.2ºC
Density
1.241g/cm³
Exact Mass
201.07900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 7-Ethylquinoline-3-carboxylic acid?
The molecular formula of 7-Ethylquinoline-3-carboxylic acid is C12H11NO2.
What is the molecular weight of 7-Ethylquinoline-3-carboxylic acid?
The molecular weight of 7-Ethylquinoline-3-carboxylic acid is 201.22 g/mol.
When was 7-Ethylquinoline-3-carboxylic acid created in the PubChem database?
7-Ethylquinoline-3-carboxylic acid was created in the PubChem database on November 13, 2007.
What is the InChIKey of 7-Ethylquinoline-3-carboxylic acid?
The InChIKey of 7-Ethylquinoline-3-carboxylic acid is WJMGUVPYUJSNMI-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in 7-Ethylquinoline-3-carboxylic acid?
There is 1 hydrogen bond donor count in 7-Ethylquinoline-3-carboxylic acid.
What is the topological polar surface area of 7-Ethylquinoline-3-carboxylic acid?
The topological polar surface area of 7-Ethylquinoline-3-carboxylic acid is 50.2 Ų.
Is the compound canonicalized in the PubChem database?
Yes, the compound is canonicalized in the PubChem database.
What is the XLogP3-AA value for 7-Ethylquinoline-3-carboxylic acid?
The XLogP3-AA value for 7-Ethylquinoline-3-carboxylic acid is 2.5.
How many rotatable bond counts are there in 7-Ethylquinoline-3-carboxylic acid?
There are 2 rotatable bond counts in 7-Ethylquinoline-3-carboxylic acid.
What is the complexity value of 7-Ethylquinoline-3-carboxylic acid?
The complexity value of 7-Ethylquinoline-3-carboxylic acid is 242.
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