CAS
94135-03-2 Purity
96%
94135-03-2 Purity
96%
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4-(3-Oxobutyl)phenyl benzoate
CAS
94135-08-7
Catalog Number
ACM94135087
Category
Other Products
Molecular Formula
C17H16O3
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What is the molecular formula of 4-(3-Oxobutyl)phenyl benzoate?
The molecular formula of 4-(3-Oxobutyl)phenyl benzoate is C17H16O3.
When was 4-(3-Oxobutyl)phenyl benzoate created and last modified in PubChem?
4-(3-Oxobutyl)phenyl benzoate was created on 2005-08-08 and last modified on 2023-12-30.
What is the IUPAC name of 4-(3-Oxobutyl)phenyl benzoate?
The IUPAC name of 4-(3-Oxobutyl)phenyl benzoate is [4-(3-oxobutyl)phenyl] benzoate.
What is the Canonical SMILES representation of 4-(3-Oxobutyl)phenyl benzoate?
The Canonical SMILES representation of 4-(3-Oxobutyl)phenyl benzoate is CC(=O)CCC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2.
What is the InChIKey of 4-(3-Oxobutyl)phenyl benzoate?
The InChIKey of 4-(3-Oxobutyl)phenyl benzoate is SGCBNKSLSODZJZ-UHFFFAOYSA-N.
What is the molecular weight of 4-(3-Oxobutyl)phenyl benzoate?
The molecular weight of 4-(3-Oxobutyl)phenyl benzoate is 268.31 g/mol.
How many hydrogen bond acceptor counts does 4-(3-Oxobutyl)phenyl benzoate have?
4-(3-Oxobutyl)phenyl benzoate has 3 hydrogen bond acceptor counts.
What is the XLogP3 value of 4-(3-Oxobutyl)phenyl benzoate?
The XLogP3 value of 4-(3-Oxobutyl)phenyl benzoate is 3.5.
What is the topological polar surface area of 4-(3-Oxobutyl)phenyl benzoate?
The topological polar surface area of 4-(3-Oxobutyl)phenyl benzoate is 43.4 Ų.
Is 4-(3-Oxobutyl)phenyl benzoate a canonicalized compound according to PubChem?
Yes, 4-(3-Oxobutyl)phenyl benzoate is a canonicalized compound according to PubChem.
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