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Structure

3-Propan-2-yloxazol-5-amine

CAS
88786-11-2
Catalog Number
ACM88786112
Category
Other Products
Molecular Weight
126.16
Molecular Formula
C6H10N2O

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Specification

Synonyms
AmbtgI80130, 3-Isopropyl-isoxazol-5-ylamine, MolPort-002-466-721, ZINC02651886, HMS1759J16, CID2115208, I80130, 88786-11-2
IUPAC Name
3-propan-2-yl-1,2-oxazol-5-amine
Canonical SMILES
CC(C)C1=NOC(=C1)N
InChI Key
GHLVMBXOBZVJIC-UHFFFAOYSA-N
Boiling Point
239.5ºC at 760 mmHg
Flash Point
98.6ºC
Density
1.07g/cm³
EC Number
402-350-3
Exact Mass
126.07900
H-Bond Acceptor
3
H-Bond Donor
1

Upstream Synthesis Route 1

  • 29509-06-6
  • 88786-11-2

Reference: [1] Journal of Medicinal Chemistry, 2012, vol. 55, # 3, p. 1082 - 1105

Upstream Synthesis Route 2

  • 64373-43-9
  • 88786-11-2

Reference: [1] Patent: WO2010/66684, 2010, A2, . Location in patent: Page/Page column 58-59

Upstream Synthesis Route 3

  • 2861-04-3
  • 88786-11-2

Reference: [1] Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984, # 5, p. 1079 - 1083

Upstream Synthesis Route 4

  • 2861-04-3
  • 88786-11-2

Reference: [1]Journal of the Chemical Society. Perkin transactions I,1984,p. 1079 - 1083

Upstream Synthesis Route 5

  • 29509-06-6
  • 88786-11-2

Reference: [1]Journal of Medicinal Chemistry,2012,vol. 55,p. 1082 - 1105

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