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| CAS No.: | 58108-05-7 |
|---|---|
| Name: | 3-Amino-3-azabicyclo[3.3.0]octane hydrochloride |
| Molecular Structure: | |
|
|
|
| Formula: | C7H14N2.HCl |
| Molecular Weight: | 162.662 |
| Synonyms: | Cyclopenta[c]pyrrol-2(1H)-amine,hexahydro-, monohydrochloride (9CI);2(1H)-Aminohexahydrocyclopenta[c]pyrrolehydrochloride;N-Amino-3-azabicyclo[3.3.0]octane hydrochloride; |
| EINECS: | 261-131-9 |
| Melting Point: | 170-174 °C(lit.) |
| Boiling Point: | 229.9 °C at 760 mmHg |
| Flash Point: | 92.9 °C |
| Appearance: | light yellow brown powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 29.26000 |
| LogP: | 2.03220 |
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N-amino-aza-3-bicyclo<3.3.0>octane
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride | 96% |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| Stage #1: N-amino-1,2-cyclopentanedicarboximide With aluminum (III) chloride In tetrahydrofuran at 45℃; for 0.333333h; Large scale; Stage #2: With sodium tetrahydroborate In tetrahydrofuran for 6h; Reflux; Large scale; Stage #3: With hydrogenchloride In tetrahydrofuran pH=3; Solvent; Temperature; Large scale; | 81.3% |
| Multi-step reaction with 2 steps 1: acetic acid; pyrographite; ruthenium(III) chloride trihydrate; hydrogen / water / 16 h / 140 °C / 60006 Torr / Autoclave 2: hydrogenchloride View Scheme |
- 21187-98-4
gliclazide
A
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toluene-4-sulfonamide
B
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With chloride ions In various solvent(s) at 37℃; for 24h; Product distribution; various concentrations of anions and cations, with and without human serum proteins; |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride; hydrazine hydrochloride In water at 140℃; under 1672.11 - 4256.29 Torr; for 5h; Autoclave; |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride; hydrazine hydrochloride In water for 4h; Reflux; |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride; hydrazine hydrochloride In water for 10h; Reflux; |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride; hydrazine hydrochloride In water at 115 - 120℃; under 1140.08 - 1900.13 Torr; Autoclave; |
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
- 1694-06-0
4-toluenesulfonylurea
- 21187-98-4
gliclazide
| Conditions | Yield |
|---|---|
| In toluene for 3h; Reflux; | 86% |
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1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 16h; | 84% |
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benzaldehyde
- 58108-05-7
3-azabicyclo<3.3.0>oct-3-yl-amine monohydrochloride
| Conditions | Yield |
|---|---|
| With magnesium sulfate; N-ethyl-N,N-diisopropylamine In dichloromethane at 20℃; | 71% |
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Specification
The Cyclopenta[c]pyrrol-2(1H)-amine,hexahydro-, hydrochloride (1:1), with the CAS registry number 58108-05-7, is also known as Cyclopenta[c]pyrrol-2(1H)-amine, hexahydro-, hydrochloride (1:1). It belongs to the product categories of Pyrrolidines; Building Blocks; Heterocyclic Building Blocks. Its EINECS registry number is 261-131-9. This chemical's molecular formula is C7H14N2.HCl and molecular weight is 162.66. Its IUPAC name is called 3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-amine hydrochloride. you should keep the storage device sealing and this chemcial should be stored in a cool, dry place.
Physical properties of Cyclopenta[c]pyrrol-2(1H)-amine,hexahydro-, hydrochloride (1:1): (1)ACD/LogP: 0.14; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 2.22; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Flash Point: 92.9 °C; (11)Melting Point: 170-174 °C(lit.); (12)Enthalpy of Vaporization: 47.6 kJ/mol; (13)Boiling Point: 229.9 °C at 760 mmHg; (14)Vapour Pressure: 0.055 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC2CN(CC2C1)N.Cl
(2)InChI: InChI=1S/C7H14N2.ClH/c8-9-4-6-2-1-3-7(6)5-9;/h6-7H,1-5,8H2;1H
(3)InChIKey: WPYNXKFLSQEEFE-UHFFFAOYSA-N