Benzoicacid,3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]-

CAS
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CAS
916766-99-9
Size
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Purity
96%
Price
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Availability
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Catalog Number

ACM916766999

Product Name

Benzoicacid,3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]-

Structure

Structure

CAS

916766-99-9

Category

Heterocyclic Organic Compound

Synonyms

3-{[(allyloxy)carbonyl]amino}-5-hydroxybenzoic acid

IUPAC Name

3-hydroxy-5-(prop-2-enoxycarbonylamino)benzoic acid

Molecular Weight

237.20874

Molecular Formula

C₁₁H₁₁NO₅

Canonical SMILES

C=CCOC(=O)NC1=CC(=CC(=C1)C(=O)O)O

InChI Key

MYOCYAGTJQROGX-UHFFFAOYSA-N

Boiling Point

398.9ºC at 760 mmHg

Melting Point

194.5ºC

Flash Point

195ºC

Density

1.412g/cm³

Exact Mass

237.06400

H-Bond Acceptor

5

H-Bond Donor

3

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]benzoic acid?

-The molecular formula is C11H11NO5.

When was the structure of 3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]benzoic acid first created?

-The structure was first created on February 29, 2008.

What is the molecular weight of 3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]benzoic acid?

-The molecular weight is 237.21 g/mol.

What is the IUPAC name of the compound?

-The IUPAC name is 3-hydroxy-5-(prop-2-enoxycarbonylamino)benzoic acid.

What is the InChIKey of 3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]benzoic acid?

-The InChIKey is MYOCYAGTJQROGX-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

-The compound has 3 hydrogen bond donor counts.

What is the exact mass of 3-hydroxy-5-[[(2-propen-1-yloxy)carbonyl]amino]benzoic acid?

-The exact mass is 237.06372245 g/mol.

What is the topological polar surface area of the compound?

-The topological polar surface area is 95.9 Å2.

How many rotatable bond counts does the compound have?

-The compound has 5 rotatable bond counts.

Is the compound canonicalized?

-Yes, the compound is canonicalized.

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