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Structure

5-Phenylisoxazole-3-carboxylic acid

CAS
14441-90-8
Catalog Number
ACM14441908
Category
Other Products
Molecular Weight
189.17
Molecular Formula
C10H7NO3

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Specification

Synonyms
ART-CHEM-BB B019304;CHEMBRDG-BB 4401205;5-PHENYLISOXAZOLE-3-CARBOXYLIC ACID;5-PHENYL-3-ISOXAZOLECARBOXYLIC ACID;AKOS PAO-1380;AKOS B019304;SALOR-INT L482528-1EA;3-isoxazolecarboxylic acid, 5-phenyl-
Melting Point
160-164°C(lit.)
Density
1.320
Hazard Statements
Xn,Xi
Safety Description
26-36-45
Supplemental Hazard Statements
H302-H315-H317-H319-H334-H335
Symbol
GHS07,GHS08
What is the molecular formula of 5-Phenylisoxazole-3-carboxylic acid according to the reference?

The molecular formula is C10H7NO3.

When was 5-Phenylisoxazole-3-carboxylic acid created and modified in PubChem?

It was created on July 10, 2005, and last modified on December 30, 2023.

What is the IUPAC Name of 5-Phenylisoxazole-3-carboxylic acid?

The IUPAC Name is 5-phenyl-1,2-oxazole-3-carboxylic acid.

What is the InChIKey of 5-Phenylisoxazole-3-carboxylic acid?

The InChIKey is XJYOBHXWBRKOQO-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 5-Phenylisoxazole-3-carboxylic acid have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of 5-Phenylisoxazole-3-carboxylic acid?

The topological polar surface area is 63.3 Ų.

How many rotatable bond counts does 5-Phenylisoxazole-3-carboxylic acid have?

It has 2 rotatable bond counts.

Is the compound is canonicalized according to PubChem?

Yes, the compound is canonicalized.

What is the molecular weight of 5-Phenylisoxazole-3-carboxylic acid?

The molecular weight is 189.17 g/mol.

What are some synonyms of 5-Phenylisoxazole-3-carboxylic acid?

Some synonyms include 5-Phenyl-isoxazole-3-carboxylic acid and 5-Phenyl-3-isoxazolecarboxylic acid.

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