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HomeProduct name list3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

  • CAS NO.：112626-50-3
  • Empirical Formula: C7H14ClN
  • Molecular Weight: 147.65
  • MDL number: MFCD06411019
  • EINECS: 601-190-3
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-01 18:09:03
3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE Structural

What is 3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE?

Description

3-Azabicyclo[3.3.0]octane hydrochloride is an organic reagent mainly used as an intermediate component in organic synthesis for the preparation of (1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylic acid hydrochloride and (1S,3aR,6aS)-Ethyl octahydrocyclopenta[c]pyrrole-1-carboxylate hydrochloride and other organic substances.

Chemical properties

White or almost white powder

The Uses of 3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

3-Azabicyclo[3.3.0]octane Hydrochloride is a reactant in the preparation of substituted pyrimidines derivatives as novel hedgehog signaling pathway inhibitors.

Properties of 3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

Melting point: 131 - 135°C
storage temp.  Inert atmosphere,Room Temperature
solubility  Chloroform (Sparingly), Methanol (Slightly)
form  Solid
color  White to Pale Yellow
InChI InChI=1S/C7H13N.ClH/c1-2-6-4-8-5-7(6)3-1;/h6-8H,1-5H2;1H

Safety information for 3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

Computed Descriptors for 3-AZABICYCLO[3.3.0]OCTANE HYDROCHLORIDE

InChIKey HVZRRRPCVOJOLJ-UHFFFAOYSA-N
SMILES C12CNCC1CCC2.Cl

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4-(2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)ETHYL)-4-AZATRICYCLO[5.2.1.0(2,6)]DEC-8-ENE-3,5-DIONE
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10-(2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)ETHYL)-9,11-DIOXO-3-OXA-4,10-DIAZATETRACYCLO[5.5.1.0(2,6).0(8,12)]TRIDEC-4-ENE-5-CARBOXYLIC ACID
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