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Structure

7-Methoxy-2H-1,4-benzoxazin-3(4h)-one

CAS
6529-94-8
Catalog Number
ACM6529948
Category
Other Products
Molecular Weight
179.172660 [g/mol]
Molecular Formula
C9H9NO3

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Specification

Synonyms
7-Methoxy-2H-benzo[b][1,4]oxazin-3(4H)-one, ST51036247, 6529-94-8, SureCN1494348, AGN-PC-00CF65, CHEMBL319453, CTK8J8716, MolPort-020-007-964, ZINC16227741, AKOS006294329, AB23658, AK110584, KB-250004, 2H-1,4-Benzoxazin-3(4H)-one, 7-methoxy-, 7-METHOXY-2H-1,4-BENZOXAZIN-3(4H)-ONE, 2H-1,4-BENZOXAZIN-3(4H)-ONE, 7-METHOXY, 7-methoxy-2H,4H-benzo[e]1,4-oxazaperhydroin-3-one, I14-12293, 7-METHOXY-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-3-ONE
IUPAC Name
7-methoxy-4H-1,4-benzoxazin-3-one
Canonical SMILES
COC1=CC2=C(C=C1)NC(=O)CO2
InChI Key
UGJVRGLKGBFDOD-UHFFFAOYSA-N
Exact Mass
179.05800
H-Bond Acceptor
3
H-Bond Donor
1

Upstream Synthesis Route 1

  • 31366-46-8
  • 102-56-7
  • 6529-94-8

Reference: [1] Journal of Heterocyclic Chemistry, 1988, vol. 25, p. 1279 - 1281

Upstream Synthesis Route 2

  • 6529-91-5
  • 6529-94-8

Reference: [1] Journal of Medicinal Chemistry, 1987, vol. 30, # 3, p. 580 - 583

Upstream Synthesis Route 3

  • 72001-30-0
  • 72594-77-5
  • 88171-01-1
  • 88171-00-0
  • 6529-94-8

Reference: [1]Heterocycles,1983,vol. 20,p. 1481 - 1485
[2]Heterocycles,1983,vol. 20,p. 1481 - 1485

Downstream Synthesis Route 1

  • 6529-94-8
  • 93735-22-9

Reference: [1] European Journal of Medicinal Chemistry, 1999, vol. 34, # 11, p. 903 - 917

Downstream Synthesis Route 2

  • 98-88-4
  • 6529-94-8
  • 92963-37-6

Reference: [1]Journal of the Chemical Society,1964,p. 3709 - 3713

Downstream Synthesis Route 3

  • 6529-94-8
  • 93735-22-9

Reference: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 903 - 917

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

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