CAS
937667-54-4 Purity
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937667-54-4 Purity
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2-Chloro-6-ethoxyquinoline-3-carbonitrile
CAS
937672-26-9
Catalog Number
ACM937672269
Category
Other Products
Molecular Weight
232.67
Molecular Formula
C12H9ClN2O
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Specification
Synonyms
2-Chloro-6-ethoxyquinoline-3-carbonitrile, 937672-26-9, AGN-PC-01A9K9, CTK8E3953, MolPort-002-679-270, ZINC11985196, AKOS000804007, AB49447, MCULE-1927387158, KB-229993
IUPAC Name
2-chloro-6-ethoxyquinoline-3-carbonitrile
Canonical SMILES
CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)Cl
InChI Key
DLSJCLCHOALFAO-UHFFFAOYSA-N
Boiling Point
404.764ºC at 760 mmHg
Flash Point
198.594ºC
Density
1.315g/cm³
Exact Mass
232.04000
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The molecular formula of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is C12H9ClN2O.
What is the molecular weight of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The molecular weight of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is 232.66 g/mol.
When was 2-Chloro-6-ethoxyquinoline-3-carbonitrile first created in the database?
2-Chloro-6-ethoxyquinoline-3-carbonitrile was first created in the database on November 13, 2007.
What is the InChIKey of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The InChIKey of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is DLSJCLCHOALFAO-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does 2-Chloro-6-ethoxyquinoline-3-carbonitrile have?
2-Chloro-6-ethoxyquinoline-3-carbonitrile has 3 hydrogen bond acceptor counts.
What is the topological polar surface area of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The topological polar surface area of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is 45.9 Ų.
Is 2-Chloro-6-ethoxyquinoline-3-carbonitrile a canonicalized compound?
Yes, 2-Chloro-6-ethoxyquinoline-3-carbonitrile is a canonicalized compound.
What is the structure of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The structure of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is represented by the chemical formula C12H9ClN2O.
What is the CAS number of 2-Chloro-6-ethoxyquinoline-3-carbonitrile?
The CAS number of 2-Chloro-6-ethoxyquinoline-3-carbonitrile is 937672-26-9.
How many rotatable bond counts does 2-Chloro-6-ethoxyquinoline-3-carbonitrile have?
2-Chloro-6-ethoxyquinoline-3-carbonitrile has 2 rotatable bond counts.
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CAS
937682-00-3 Purity
96%
937682-00-3 Purity
96%
