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Structure

5-amino-2,3-dihydro-1,3-benzoxazol-2-one

CAS
14733-77-8
Catalog Number
ACM14733778
Category
Main Products
Molecular Weight
150.1
Molecular Formula
C7H6N2O2

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What is the molecular formula of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The molecular formula is C7H6N2O2.

What is the molecular weight of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The molecular weight is 150.13 g/mol.

What are the synonyms of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The synonyms include 14733-77-8, 5-Aminobenzo[d]oxazol-2(3H)-one, 2(3H)-Benzoxazolone, 5-amino-, 5-amino-1,3-benzoxazol-2(3H)-one, and 5-amino-3H-1,3-benzoxazol-2-one.

What is the IUPAC name of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The IUPAC name is 5-amino-3H-1,3-benzoxazol-2-one.

What is the InChI of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The InChI is InChI=1S/C7H6N2O2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,8H2,(H,9,10).

What is the InChIKey of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The InChIKey is GJXXUHGUCBUXSL-UHFFFAOYSA-N.

What is the canonical SMILES of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The canonical SMILES is C1=CC2=C(C=C1N)NC(=O)O2.

What is the CAS number of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The CAS number is 14733-77-8.

What is the XLogP3 value of 5-amino-2,3-dihydro-1,3-benzoxazol-2-one?

The XLogP3 value is 0.5.

How many hydrogen bond acceptors does 5-amino-2,3-dihydro-1,3-benzoxazol-2-one have?

It has 3 hydrogen bond acceptors.

Upstream Synthesis Route 1

  • 3889-13-2
  • 14733-77-8

Reference: [1]Patent: WO2012/59932,2012,A1 .Location in patent: Page/Page column 165

Downstream Synthesis Route 1

  • 14733-77-8
  • 14733-73-4

Reference: [1] Journal of Medicinal Chemistry, 1967, vol. 10, p. 408 - 410

Downstream Synthesis Route 2

  • 590-28-3
  • 14733-77-8
  • 101421-11-8

Reference: [1]Journal of the American Chemical Society,1958,vol. 80,p. 1662

Downstream Synthesis Route 3

  • 14733-77-8
  • 108-24-7
  • 103858-71-5

Reference: [1]Chemische Berichte,1960,vol. 93,p. 1331 - 1339

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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