CAS
96916-53-9 Purity
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96916-53-9 Purity
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3-(4-Fluorobenzoyl)tropane
CAS
96920-56-8
Catalog Number
ACM96920568
Category
Other Products
Molecular Weight
247.307923 [g/mol]
Molecular Formula
C15H18FNO
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Specification
Synonyms
3-Fbot, 3-(4-Fluorobenzoyl)tropane, CID126134, Methanone, (4-fluorophenyl)(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-, 96920-56-8
IUPAC Name
(4-fluorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-4-yl)methanone
InChI Key
OMZLALUYZBKDPQ-UHFFFAOYSA-N
Boiling Point
348.5ºC at 760mmHg
Flash Point
164.6ºC
Density
1.149g/cm³
Exact Mass
247.13700
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 3-(4-Fluorobenzoyl)tropane?
The molecular formula is C15H18FNO.
When was 3-(4-Fluorobenzoyl)tropane created?
It was created on December 5, 2007.
What is the IUPAC name of 3-(4-Fluorobenzoyl)tropane?
The IUPAC name is (4-fluorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.
What is the InChIKey of 3-(4-Fluorobenzoyl)tropane?
The InChIKey is SFKXMCNVYWUQCL-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does 3-(4-Fluorobenzoyl)tropane have?
It has 3 hydrogen bond acceptor counts.
What is the XLogP3-AA value of 3-(4-Fluorobenzoyl)tropane?
The XLogP3-AA value is 2.8.
What is the topological polar surface area of 3-(4-Fluorobenzoyl)tropane?
The topological polar surface area is 20.3 Ų.
How many rotatable bond counts does 3-(4-Fluorobenzoyl)tropane have?
It has 2 rotatable bond counts.
What is the exact mass of 3-(4-Fluorobenzoyl)tropane?
The exact mass is 247.137242360 g/mol.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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