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Structure

7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid

CAS
898792-39-7
Catalog Number
ACM898792397
Category
Other Products
Molecular Weight
280.32
Molecular Formula
C15H20O5

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Specification

Synonyms
7-(2,4-DIMETHOXYPHENYL)-7-OXOHEPTANOIC ACID
IUPAC Name
7-(2,4-dimethoxyphenyl)-7-oxoheptanoic acid
Canonical SMILES
COC1=CC(=C(C=C1)C(=O)CCCCCC(=O)O)OC
InChI Key
MFHLHDGLOBHRED-UHFFFAOYSA-N
Boiling Point
476.6ºC at 760 mmHg
Flash Point
175.5ºC
Density
1.138g/cm³
Exact Mass
280.13100
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid?

The molecular formula is C15H20O5.

When was 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid first created?

It was first created on February 29, 2008.

What is the molecular weight of 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid?

The molecular weight is 280.32 g/mol.

What is the InChI key of 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid?

The InChI key is MFHLHDGLOBHRED-UHFFFAOYSA-N.

How many Hydrogen Bond Donor Counts does 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid have?

It has 1 Hydrogen Bond Donor Count.

What is the topological polar surface area of 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid?

The topological polar surface area is 72.8 Ų.

Is 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid a canonicalized compound?

Yes, the compound is canonicalized.

How many defined atom stereocenter counts does 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid have?

It has 0 defined atom stereocenter count.

What is the complexity value of 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid?

The complexity value is 315.

How many covalently-bonded unit counts does 7-(2,4-Dimethoxyphenyl)-7-oxoheptanoic acid have?

It has 1 covalently-bonded unit count.

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