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205647-96-7

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205647-96-7 Structure

205647-96-7 Structure
IdentificationBack Directory
[Name]

(3aS,8aR)-2-(pyridin-2-yl)-8,8a-dihydro-3aH-indeno[1,2-d]oxazole
[CAS]

205647-96-7
[Synonyms]

(S,R)-In-Pyox
(3aS,8aR)-2-(pyridin-2-yl)-3a,8a-dihydro-8H-indeno[1,2-d]oxazole
(3aS,8aR)-2-(pyridin-2-yl)-8,8a-dihydro-3aH-indeno[1,2-d]oxazole
8H-Indeno[1,2-d]oxazole, 3a,8a-dihydro-2-(2-pyridinyl)-, (3aS,8aR)-
[Molecular Formula]

C15H12N2O
[MDL Number]

MFCD31706433
[MOL File]

205647-96-7.mol
[Molecular Weight]

236.27
Chemical PropertiesBack Directory
[Boiling point ]

418.3±45.0 °C(Predicted)
[density ]

1.34±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

3.97±0.20(Predicted)
[InChI]

InChI=1S/C15H12N2O/c1-2-6-11-10(5-1)9-13-14(11)17-15(18-13)12-7-3-4-8-16-12/h1-8,13-14H,9H2/t13-,14+/m1/s1
[InChIKey]

JPCAXHBKQLBOJG-KGLIPLIRSA-N
[SMILES]

O1[C@]2([H])CC3=C([C@]2([H])N=C1C1=NC=CC=C1)C=CC=C3
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

(3aS,8aR)-2-(pyridin-2-yl)-8,8a-dihydro-3aH-indeno[1,2-d]oxazole(205647-96-7)1HNMR
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