CAS
898793-65-2 Purity
96%
898793-65-2 Purity
96%
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Cyclobutyl 3-(piperidinomethyl)phenyl ketone
CAS
898793-68-5
Catalog Number
ACM898793685
Category
Other Products
Molecular Weight
257.37
Molecular Formula
C17H23NO
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Specification
Synonyms
CYCLOBUTYL 3-(PIPERIDINOMETHYL)PHENYL KETONE
IUPAC Name
cyclobutyl-[3-(piperidin-1-ylmethyl)phenyl]methanone
SMILES
C1CCN(CC1)CC2=CC=CC(=C2)C(=O)C3CCC3
InChI Key
BTUBPGBTQNHCTF-UHFFFAOYSA-N
Boiling Point
385ºC at 760 mmHg
Flash Point
140.1ºC
Density
1.098g/cm³
Exact Mass
257.17800
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
The molecular formula is C17H23NO.
When was Cyclobutyl 3-(piperidinomethyl)phenyl ketone first created and modified in PubChem?
It was created on February 29, 2008, and last modified on December 30, 2023.
What is the IUPAC Name of Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
The IUPAC Name is cyclobutyl-[3-(piperidin-1-ylmethyl)phenyl]methanone.
What is the InChIKey of Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
The InChIKey is BTUBPGBTQNHCTF-UHFFFAOYSA-N.
How many hydrogen bond acceptors are present in Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
There are 2 hydrogen bond acceptors.
What is the exact mass of Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
The exact mass is 257.177964357 g/mol.
How many rotatable bonds are present in the molecule?
There are 4 rotatable bonds.
Is Cyclobutyl 3-(piperidinomethyl)phenyl ketone a canonicalized compound?
Yes, it is canonicalized.
How many heavy atoms are present in the molecule?
There are 19 heavy atoms.
What is the topological polar surface area of Cyclobutyl 3-(piperidinomethyl)phenyl ketone?
The topological polar surface area is 20.3 Ų.
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