CAS
948290-88-8 Purity
96%
948290-88-8 Purity
96%
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2,5,7-Trimethylquinoline-3-carboxylic acid
CAS
948290-95-7
Catalog Number
ACM948290957
Category
Other Products
Molecular Weight
215.25
Molecular Formula
C13H13NO2
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Specification
Synonyms
2,5,7-Trimethylquinoline-3-carboxylic acid, 948290-95-7, AGN-PC-01A9G9, CTK8E3518, AKOS015868497, AB51602, MCULE-4843436787
IUPAC Name
2,5,7-trimethylquinoline-3-carboxylic acid
Canonical SMILES
CC1=CC2=NC(=C(C=C2C(=C1)C)C(=O)O)C
InChI Key
XKRJSXZTFXNQJY-UHFFFAOYSA-N
Boiling Point
372.1ºC at 760 mmHg
Flash Point
178.9ºC
Density
1.208g/cm³
Exact Mass
215.09500
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The molecular formula is C13H13NO2.
When was 2,5,7-Trimethylquinoline-3-carboxylic acid created in PubChem?
It was created on November 13, 2007.
What is the IUPAC name of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The IUPAC name is 2,5,7-trimethylquinoline-3-carboxylic acid.
What is the Canonical SMILES representation of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The Canonical SMILES is CC1=CC(=C2C=C(C(=NC2=C1)C)C(=O)O)C.
What is the molecular weight of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The molecular weight is 215.25 g/mol.
How many hydrogen bond donor counts does 2,5,7-Trimethylquinoline-3-carboxylic acid have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The topological polar surface area is 50.2 Ų.
Is 2,5,7-Trimethylquinoline-3-carboxylic acid a canonicalized compound in PubChem?
Yes, it is a canonicalized compound.
What is the XLogP3-AA value of 2,5,7-Trimethylquinoline-3-carboxylic acid?
The XLogP3-AA value is 2.8.
How many covalently-bonded unit counts does 2,5,7-Trimethylquinoline-3-carboxylic acid have?
It has 1 covalently-bonded unit count.
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