CAS
898792-17-1 Purity
96%
898792-17-1 Purity
96%
Inquiry Basket
3-Carboethoxyphenyl cyclohexyl ketone
CAS
898792-20-6
Catalog Number
ACM898792206
Category
Other Products
Molecular Weight
260.33
Molecular Formula
C16H20O3
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
3-CARBOETHOXYPHENYL CYCLOHEXYL KETONE
IUPAC Name
ethyl 3-(cyclohexanecarbonyl)benzoate
Canonical SMILES
CCOC(=O)C1=CC=CC(=C1)C(=O)C2CCCCC2
InChI Key
MINBUUGOYLHGFS-UHFFFAOYSA-N
Boiling Point
395.1ºC at 760 mmHg
Flash Point
173.9ºC
Density
1.094g/cm³
Exact Mass
260.14100
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 3-Carboethoxyphenyl cyclohexyl ketone?
The molecular formula of 3-Carboethoxyphenyl cyclohexyl ketone is C16H20O3.
When was 3-Carboethoxyphenyl cyclohexyl ketone created and last modified in PubChem?
3-Carboethoxyphenyl cyclohexyl ketone was created on 2008-02-29 and last modified on 2023-12-30.
What is the IUPAC name of 3-Carboethoxyphenyl cyclohexyl ketone?
The IUPAC name of 3-Carboethoxyphenyl cyclohexyl ketone is ethyl 3-(cyclohexanecarbonyl)benzoate.
What is the InChIKey of 3-Carboethoxyphenyl cyclohexyl ketone?
The InChlKey of 3-Carboethoxyphenyl cyclohexyl ketone is MINBUUGOYLHGFS-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 3-Carboethoxyphenyl cyclohexyl ketone?
The Canonical SMILES representation of 3-Carboethoxyphenyl cyclohexyl ketone is CCOC(=O)C1=CC=CC(=C1)C(=O)C2CCCCC2.
What is the molecular weight of 3-Carboethoxyphenyl cyclohexyl ketone?
The molecular weight of 3-Carboethoxyphenyl cyclohexyl ketone is 260.33 g/mol.
How many hydrogen bond acceptors does 3-Carboethoxyphenyl cyclohexyl ketone have?
3-Carboethoxyphenyl cyclohexyl ketone has 3 hydrogen bond acceptors.
What is the topological polar surface area of 3-Carboethoxyphenyl cyclohexyl ketone?
The topological polar surface area of 3-Carboethoxyphenyl cyclohexyl ketone is 43.4 Å^2.
How many rotatable bond count does 3-Carboethoxyphenyl cyclohexyl ketone have?
3-Carboethoxyphenyl cyclohexyl ketone has 5 rotatable bond counts.
Is 3-Carboethoxyphenyl cyclohexyl ketone a canonicalized compound according to PubChem?
Yes, 3-Carboethoxyphenyl cyclohexyl ketone is a canonicalized compound according to PubChem.
Recommended Products
