CAS
898793-15-2 Purity
96%
898793-15-2 Purity
96%
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Ethyl 4-(3,5-dimethyl-4-methoxyphenyl)-4-oxobutyrate
CAS
898793-18-5
Catalog Number
ACM898793185
Category
Other Products
Molecular Weight
264.32
Molecular Formula
C15H20O4
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Specification
Synonyms
ETHYL 4-(3,5-DIMETHYL-4-METHOXYPHENYL)-4-OXOBUTYRATE
IUPAC Name
ethyl 4-(4-methoxy-3,5-dimethylphenyl)-4-oxobutanoate
Canonical SMILES
CCOC(=O)CCC(=O)C1=CC(=C(C(=C1)C)OC)C
InChI Key
OCDPSMHZGWXQKO-UHFFFAOYSA-N
Boiling Point
398.1ºC at 760 mmHg
Flash Point
175.2ºC
Density
1.07g/cm³
Exact Mass
264.13600
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of the compound with PubChem CID 24727306?
The molecular formula is C15H20O4.
When was the compound created in PubChem?
The compound was created on February 29, 2008.
What is the IUPAC name of the compound?
The IUPAC name is ethyl 4-(4-methoxy-3,5-dimethylphenyl)-4-oxobutanoate.
What is the molecular weight of the compound?
The molecular weight is 264.32 g/mol.
How many hydrogen bond acceptor counts are there in the compound?
There are 4 hydrogen bond acceptor counts in the compound.
What is the exact mass of the compound?
The exact mass is 264.13615911 g/mol.
How many rotatable bond counts are there in the compound?
There are 7 rotatable bond counts in the compound.
Is the compound's structure canonicalized?
Yes, the compound's structure is canonicalized.
What is the topological polar surface area of the compound?
The topological polar surface area is 52.6 Ų.
What is the InChIKey of the compound?
The InChIKey is OCDPSMHZGWXQKO-UHFFFAOYSA-N.
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