CAS
948292-01-1 Purity
96%
948292-01-1 Purity
96%
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3-Chloromethyl-2,6-dichloro-8-methylquinoline
CAS
948292-19-1
Catalog Number
ACM948292191
Category
Other Products
Molecular Weight
260.546920 [g/mol]
Molecular Formula
C11H8Cl3N
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Specification
Synonyms
3-Chloromethyl-2,6-dichloro-8-methylquinoline, 2,6-DICHLORO-3-(CHLOROMETHYL)-8-METHYLQUINOLINE, 948292-19-1, AGN-PC-01A9KT, ZINC11985134, AKOS012535009, AB52001
IUPAC Name
2,6-dichloro-3-(chloromethyl)-8-methylquinoline
InChI Key
XVJPSHJXHVPAID-UHFFFAOYSA-N
Boiling Point
373ºC at 760 mmHg
Flash Point
211.1ºC
Density
1.411g/cm³
Exact Mass
258.97200
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The molecular formula is C11H8Cl3N.
What is the molecular weight of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The molecular weight is 260.5 g/mol.
What is the IUPAC name of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The IUPAC name is 2,6-dichloro-3-(chloromethyl)-8-methylquinoline.
What is the InChI of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The InChI is InChI=1S/C11H8Cl3N/c1-6-2-9(13)4-7-3-8(5-12)11(14)15-10(6)7/h2-4H,5H2,1H3.
What is the InChIKey of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The InChIKey is XVJPSHJXHVPAID-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The canonical SMILES is CC1=CC(=CC2=CC(=C(N=C12)Cl)CCl)Cl.
What is the XLogP3-AA value of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The XLogP3-AA value is 4.5.
How many hydrogen bond acceptors does 3-Chloromethyl-2,6-dichloro-8-methylquinoline have?
It has 1 hydrogen bond acceptor.
What is the topological polar surface area of 3-Chloromethyl-2,6-dichloro-8-methylquinoline?
The topological polar surface area is 12.92.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized.
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