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| CAS No.: | 334618-23-4 |
|---|---|
| Name: | (R)-3-Piperidinamine dihydrochloride |
| Article Data: | 25 |
| Molecular Structure: | |
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|
|
| Formula: | C5H14Cl2N2 |
| Molecular Weight: | 136.625 |
| Synonyms: | 3-Piperidinamine,dihydrochloride, (3R)- (9CI);(R)-(-)-3-Aminopiperidine dihydrochloride; |
| EINECS: | 608-870-9 |
| Melting Point: | 190-195 °C |
| Boiling Point: | 241.9 °C at 760 mmHg |
| Flash Point: | 100.1 °C |
| Solubility: | soluble in water |
| Appearance: | white powder |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22-37/38-41 |
| Safety: | 26-39 |
| PSA: | 38.05000 |
| LogP: | 2.33020 |
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Specification
The IUPAC name of (R)-3-Aminopiperidine dihydrochloride is (3R)-piperidin-3-amine dihydrochloride. With the CAS registry number 334618-23-4, it is also named as (R)-3-Piperidinamine dihydrochloride. The product's categories are Pharmacetical; Piperidine; Piperidines. It is white powder which is soluble in water and hygroscopic. Additionally, this chemical should be sealed in the container and stored in the cool and dry place at the room temperature.
The other characteristics of (R)-3-Aminopiperidine dihydrochloride can be summarized as: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 38.05 Å2; (10)Flash Point: 100.1 °C; (11)Enthalpy of Vaporization: 48.86 kJ/mol; (12)Boiling Point: 241.9 °C at 760 mmHg; (13)Vapour Pressure: 0.028 mmHg at 25°C; (14)Exact Mass: 172.053404; (15)MonoIsotopic Mass: 172.053404; (16)Topological Polar Surface Area: 38; (17)Heavy Atom Count: 9; (18)Complexity: 54; (19)Defined Atom StereoCenter Count: 1.
When you are using this chemical, please be cautious about it as the following:
It is not only harmful if swallowed, but also irritating to respiratory system and skin. What's more, it has risk of serious damage to the eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear eye / face protection.
People can use the following data to convert to the molecule structure.
1. SMILES:Cl.Cl.N[C@@H]1CCCNC1
2. InChI:InChI=1/C5H12N2.2ClH/c6-5-2-1-3-7-4-5;;/h5,7H,1-4,6H2;2*1H/t5-;;/m1../s1
3. InChIKey:GGPNYXIOFZLNKW-ZJIMSODOBQ
4. Std. InChI:InChI=1S/C5H12N2.2ClH/c6-5-2-1-3-7-4-5;;/h5,7H,1-4,6H2;2*1H/t5-;;/m1../s1
5. Std. InChIKey:GGPNYXIOFZLNKW-ZJIMSODOSA-N
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