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Structure

2-Chloro-3-(6-chlorohexanoyl)pyridine

CAS
914203-37-5
Catalog Number
ACM914203375
Category
Other Products
Molecular Weight
246.13
Molecular Formula
C11H13Cl2NO

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Specification

Synonyms
2-CHLORO-3-(6-CHLOROHEXANOYL)PYRIDINE
IUPAC Name
6-chloro-1-(2-chloropyridin-3-yl)hexan-1-one
Canonical SMILES
C1=CC(=C(N=C1)Cl)C(=O)CCCCCCl
InChI Key
YUWNGQAOWCFSCO-UHFFFAOYSA-N
Boiling Point
358.7ºC at 760 mmHg
Flash Point
170.7ºC
Density
1.209g/cm³
Exact Mass
245.03700
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The molecular formula of 2-Chloro-3-(6-chlorohexanoyl)pyridine is C11H13Cl2NO.

When was 2-Chloro-3-(6-chlorohexanoyl)pyridine created in PubChem?

2-Chloro-3-(6-chlorohexanoyl)pyridine was created in PubChem on 2008-02-29.

What is the IUPAC Name of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The IUPAC Name of 2-Chloro-3-(6-chlorohexanoyl)pyridine is 6-chloro-1-(2-chloropyridin-3-yl)hexan-1-one.

What is the Canonical SMILES representation of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The Canonical SMILES representation of 2-Chloro-3-(6-chlorohexanoyl)pyridine is C1=CC(=C(N=C1)Cl)C(=O)CCCCCCl.

What is the molecular weight of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The molecular weight of 2-Chloro-3-(6-chlorohexanoyl)pyridine is 246.13 g/mol.

How many hydrogen bond acceptors are in the structure of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

There are 2 hydrogen bond acceptors in the structure of 2-Chloro-3-(6-chlorohexanoyl)pyridine.

What is the XLogP3-AA value of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The XLogP3-AA value of 2-Chloro-3-(6-chlorohexanoyl)pyridine is 3.1.

What is the topological polar surface area of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

The topological polar surface area of 2-Chloro-3-(6-chlorohexanoyl)pyridine is 30Ų.

How many rotatable bonds are present in the structure of 2-Chloro-3-(6-chlorohexanoyl)pyridine?

There are 6 rotatable bonds in the structure of 2-Chloro-3-(6-chlorohexanoyl)pyridine.

Is 2-Chloro-3-(6-chlorohexanoyl)pyridine a canonicalized compound in PubChem?

Yes, 2-Chloro-3-(6-chlorohexanoyl)pyridine is a canonicalized compound in PubChem.

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