cis-Octahydropyrrolo[3,4-b]pyridine

What is cis-Octahydropyrrolo[3,4-b]pyridine, cas no. 147459-51-6,a producer telling you the result.

What is cis-Octahydropyrrolo[3,4-b]pyridine, cas no. 147459-51-6,a producer telling you the result.

                                                                CAS NO. 147459-51-6

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To begin with, let us tell you what is the basic information of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6 ?

Molecular Formula

C7H14N2

Molecular Weight

126.200

Density

0.950±0.06 g/cm3

Boiling Point

198.5±8.0 °C at 760 mmHg

Flash Point

87.1±10.2 °C

Exact Mass

126.115700

 

Like many stuff, it has many synonyms as follows

cis-Octahydropyrrolo[3,4-b]pyridine

Moxifloxacin Impurity 15

1H-Pyrrolo[3,4-b]pyridine, octahydro-, (4aR,7aR)-

(R,R)-2,8-diazabicyclo[4,3,0]nonane

(4aR,7aR)-Octahydro-1H-pyrrolo[3,4-b]pyridine

(4aR,7aR)-rel-Octahydro-1H-pyrrolo[3,4-b]pyridine

 

First, the chemical is very special, some technical indexes as below

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Experimental characteristics

LogP 0.61540

PSA 24.06000

Refractive index 1.469

Boiling point 198.5 ° C at 760 mmHg

Flash point 87.1 ± 10.2 º C,

Solubility is easily soluble (279 g/L) (25 º C),

Density 0.950 ± 0.06 g/cm3 (20 º C 760 Torr),

Computational characteristics

Accurate molecular weight 126.11600

Number of hydrogen bond donors 2

Number of hydrogen bond acceptors 2

Number of rotatable chemical bonds 0

Isotope mass 126.116

Number of heavy atoms 9

Complexity 103

Isotope atomic number 0

Determine the number of atomic structure centers 2

Uncertain number of atomic structure centers 0

Determine the number of chemical bond stereocenters 0

Uncertain number of chemical bond stereocenters 0

Number of covalent bond units 1

Reference value for hydrophobic parameter calculation (XlogP) 0

Number of tautomeric variants N/A

Surface charge 0

Topological molecule polarity surface area 24.1

security information

Hazard Statement H302-H319

Warning statement P305+P351+P338

Storage conditions Keep in dark place, Inert atmosphere, 2-8 ° C

Signal word Warning

 

Second, the Synthetic Route we will recommend is the most important for your reference?

First, synthesis line of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6 as follows

Starting from 8-benzyl-2,8-diazabicyclo [4.3.0] nonane, (R, R) -2,8-diazabicyclo [4.3.0] nonane with a content>99.5% was purified by L - (+) - tartaric acid separation, Pd/C catalytic hydrogenation and debenzylation, with a total yield of 66.5%

Third, what is the usage of  cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6  pleas see below

 

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Mainly used for Impurity control and analysis detection

 

 

Besides Safety Information of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6 is also important when handling it

 

Hazard Codes 

Xi

WGK Germany 

3

HSCode

2933490090

TSCA 

Yes

HazardClass 

IRRITANT

 

 

What is the appearance of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6?   Please see the picture of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6, below

 

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Specification of cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6, is below

Apperance: colorless clear liquid

Assay: 99 % min by GC

IR identity: conform

Water:0.1% max by K.F.

HNMR  picture of  cis-Octahydropyrrolo[3,4-b]pyridine CAS NO. 147459-51-6  is as follows,

 

Reference of  Article cited for your reference below,

(1)

Indole derivative-containing inhibitor, preparation method therefor and application thereof

Publication Number: AU-2020277541-A1

Priority Date: 2019-05-22

(2)

(3)