CAS
905807-58-1 Purity
96%
905807-58-1 Purity
96%
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Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate
CAS
905807-62-7
Catalog Number
ACM905807627
Category
Other Products
Molecular Weight
251.67
Molecular Formula
C12H10ClNO3
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Specification
Synonyms
METHYL 4-CHLORO-6-METHOXY-QUINOLINE-2-CARBOXYLATE;2-QUINOLINECARBOXYLIC ACID, 4-CHLORO-6-METHOXY-, METHYL ESTER
IUPAC Name
methyl 4-chloro-6-methoxyquinoline-2-carboxylate
Canonical SMILES
COC1=CC2=C(C=C1)N=C(C=C2Cl)C(=O)OC
InChI Key
YSQVEEOSHQVGMK-UHFFFAOYSA-N
Boiling Point
382.9ºC at 760 mmHg
Flash Point
185.4ºC
Density
1.32g/cm³
Exact Mass
251.03500
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The molecular formula is C12H10ClNO3.
When was Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate created in PubChem?
It was created on 2009-05-28.
What is the IUPAC Name of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The IUPAC Name is methyl 4-chloro-6-methoxyquinoline-2-carboxylate.
What is the Canonical SMILES of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The Canonical SMILES is COC1=CC2=C(C=C1)N=C(C=C2Cl)C(=O)OC.
What is the molecular weight of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The molecular weight is 251.66 g/mol.
What is the XLogP3-AA value of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The XLogP3-AA value is 3.
How many hydrogen bond acceptor counts are there in Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
There are 4 hydrogen bond acceptor counts.
What is the topological polar surface area of Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
The topological polar surface area is 48.4 Ų.
How many rotatable bond counts are there in Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate?
There are 3 rotatable bond counts.
Is Methyl 4-chloro-6-methoxy-quinoline-2-carboxylate the canonicalized compound?
Yes, it is the canonicalized compound.
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