CAS
948290-64-0 Purity
96%
948290-64-0 Purity
96%
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2-Chloro-3-chloromethyl-6,8-dimethylquinoline
CAS
948290-71-9
Catalog Number
ACM948290719
Category
Other Products
Molecular Weight
240.13
Molecular Formula
C12H11Cl2N
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Specification
Synonyms
2-Chloro-3-chloromethyl-6,8-dimethylquinoline, 948290-71-9, AGN-PC-01A9JR, CTK8E3889, ZINC11985081, AKOS012534614, AB51911, 2-chloro-3-(chloromethyl)-6,8-dimethylquinoline
IUPAC Name
2-chloro-3-(chloromethyl)-6,8-dimethylquinoline
Canonical SMILES
CC1=CC(=C2C(=C1)C=C(C(=N2)Cl)CCl)C
InChI Key
CWSRGSBHXSKFHH-UHFFFAOYSA-N
Boiling Point
364.1ºC at 760 mmHg
Flash Point
205.5ºC
Density
1.27g/cm³
Exact Mass
239.02700
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The molecular formula is C12H11Cl2N.
When was 2-Chloro-3-chloromethyl-6,8-dimethylquinoline created and last modified?
It was created on November 13, 2007, and last modified on December 30, 2023.
What is the IUPAC name of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The IUPAC name is 2-chloro-3-(chloromethyl)-6,8-dimethylquinoline.
What is the InChI of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The InChI is InChI=1S/C12H11Cl2N/c1-7-3-8(2)11-9(4-7)5-10(6-13)12(14)15-11/h3-5H,6H2,1-2H3.
What is the InChIKey of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The InChIKey is CWSRGSBHXSKFHH-UHFFFAOYSA-N.
How much does 2-Chloro-3-chloromethyl-6,8-dimethylquinoline weigh?
It weighs 240.12 g/mol.
What is the Canonical SMILES of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The Canonical SMILES is CC1=CC(=C2C(=C1)C=C(C(=N2)Cl)CCl)C.
How many hydrogen bond donor counts are there in 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
There are 0 hydrogen bond donor counts.
What is the topological polar surface area of 2-Chloro-3-chloromethyl-6,8-dimethylquinoline?
The topological polar surface area is 12.9 Ų.
Is 2-Chloro-3-chloromethyl-6,8-dimethylquinoline a canonicalized compound?
Yes, the compound is canonicalized.
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