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Structure

5-Fluoro-6-hydroxy-indan-1-one

CAS
917885-01-9
Catalog Number
ACM917885019
Category
Other Products
Molecular Weight
166.149083 [g/mol]
Molecular Formula
C9H7FO2

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Specification

Synonyms
MolPort-003-982-368, 5-FLUORO-6-HYDROXY-INDAN-1-ONE, TC-066173, I14-5688, 917885-01-9
IUPAC Name
5-fluoro-6-hydroxy-2,3-dihydroinden-1-one
Canonical SMILES
C1CC(=O)C2=CC(=C(C=C21)F)O
InChI Key
YRHPPGLYOYCXOT-UHFFFAOYSA-N
Boiling Point
323.17ºC at 760 mmHg
Flash Point
149.248ºC
Density
1.412g/cm³
Exact Mass
166.04300
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 5-Fluoro-6-hydroxy-indan-1-one?

The molecular formula of 5-Fluoro-6-hydroxy-indan-1-one is C9H7FO2.

What are some synonyms for 5-Fluoro-6-hydroxy-indan-1-one?

Some synonyms for 5-Fluoro-6-hydroxy-indan-1-one include 5-Fluoro-6-hydroxy-2,3-dihydro-1H-inden-1-one and 5-FLUORO-6-HYDROXYINDAN-1-ONE.

When was 5-Fluoro-6-hydroxy-indan-1-one created and last modified in PubChem?

5-Fluoro-6-hydroxy-indan-1-one was created on 2010-03-23 and last modified on 2023-12-30 in PubChem.

What is the InChIKey of 5-Fluoro-6-hydroxy-indan-1-one?

The InChIKey of 5-Fluoro-6-hydroxy-indan-1-one is YRHPPGLYOYCXOT-UHFFFAOYSA-N.

What is the XLogP3-AA value of 5-Fluoro-6-hydroxy-indan-1-one?

The XLogP3-AA value of 5-Fluoro-6-hydroxy-indan-1-one is 1.4.

How many hydrogen bond donors are there in 5-Fluoro-6-hydroxy-indan-1-one?

There is 1 hydrogen bond donor in 5-Fluoro-6-hydroxy-indan-1-one.

What is the exact mass of 5-Fluoro-6-hydroxy-indan-1-one?

The exact mass of 5-Fluoro-6-hydroxy-indan-1-one is 166.04300762 g/mol.

What is the topological polar surface area of 5-Fluoro-6-hydroxy-indan-1-one?

The topological polar surface area of 5-Fluoro-6-hydroxy-indan-1-one is 37.3 2.

How many defined atom stereocenters are there in 5-Fluoro-6-hydroxy-indan-1-one?

There are 0 defined atom stereocenters in 5-Fluoro-6-hydroxy-indan-1-one.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.

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