Octahydro-1H-pyrrolo[3,4-b]pyridine

Basic Information

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CAS Number

5654-94-4

Molecular Formula

C7H14N2

Molecular Weight

126.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

198.5±8.0 ºC (760 Torr),

Flash Point

87.1±10.2 ºC,

Refractive Index

1.469

SMILES

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C1CC2CNCC2NC1

InChI

InChI=1S/C7H14N2/c1-2-6-4-8-5-7(6)9-3-1/h6-9H,1-5H2

InChIKey

KSCPLKVBWDOSAI-UHFFFAOYSA-N

LogP

-0.04220000000000024

Topological Polar Surface Area

24.06 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

103

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

AM84470
(4aS,7aS)-1H-octahydropyrrolo[3,4-b]pyridine
Octahydropyrrolo[3,4-b]pyridine
PB15781
SB19935
FT-0650356
SY003240
(1R,6R)-2,8-Diazabicyclo[4.3.0]nonane
151213-42-2
AKOS015904634
1H-OCTAHYDROPYRROLO[3,4-B]PYRIDINE
(4AR,7AR)-REL-OCTAHYDRO-1H-PYRROLO[3,4-B]PYRIDINE
BGA21342
SB45612
SY005300
AB29160
KSCPLKVBWDOSAI-UHFFFAOYSA-N
AS-50340
MFCD06795498
FT-0603877
(4aR,7aR)-1H-octahydropyrrolo[3,4-b]pyridine
AMY21694
MFCD09954739
DTXSID001294232
EN300-171333
SY005281
2,8-DIAZABICYCLO[4.3.0]NONANE
5654-94-4
MFCD08458306
O12035
SCHEMBL64396

MDL Number

MFCD06795498

FAQ

What is Octahydro-1H-pyrrolo[3,4-b]pyridine (CAS: 5654-94-4)?

Octahydro-1H-pyrrolo[3,4-b]pyridine is a heterocyclic compound with the molecular formula C8H11N. It is characterized by a pyrrolo[3,4-b]pyridine ring system and is used in pharmaceuticals and research due to its unique chemical properties.

What are the main uses of Octahydro-1H-pyrrolo[3,4-b]pyridine (CAS: 5654-94-4)?

Octahydro-1H-pyrrolo[3,4-b]pyridine is primarily used in the pharmaceutical industry for its biological activities, particularly in research and development of certain drugs. It also has applications in chemical synthesis and as a reagent in academic and industrial research.

Is Octahydro-1H-pyrrolo[3,4-b]pyridine (CAS: 5654-94-4) safe?

Octahydro-1H-pyrrolo[3,4-b]pyridine is safe when handled with appropriate precautions. Users should avoid skin and eye contact, inhalation, and ingestion. Protective equipment such as gloves and goggles should be worn during handling. Ingestion and inhalation can be hazardous, and skin contact can cause irritation.

How should Octahydro-1H-pyrrolo[3,4-b]pyridine (CAS: 5654-94-4) be stored?

Octahydro-1H-pyrrolo[3,4-b]pyridine should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and light exposure. The storage area should have proper ventilation to avoid the accumulation of flammable or toxic gases.