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| CAS No.: | 73365-02-3 |
|---|---|
| Name: | N-(TERT-BUTOXYCARBONYL)-D-PROLINAL |
| Article Data: | 40 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C10H17NO3 |
| Molecular Weight: | 199.25 |
| Synonyms: | 1-Pyrrolidinecarboxylicacid, 2-formyl-, 1,1-dimethylethyl ester, (R)-;(2R)-2-Formylpyrrolidine-1-carboxylicacid tert-butyl ester;(R)-2-Formylpyrrolidine-1-carboxylic acid tert-butylester;1,1-Dimethylethyl (2R)-2-formyl-1-pyrrolidinecarboxylate;N-(tert-Butoxycarbonyl)-D-prolinal;N-Boc-D-prolinal;tert-Butyl(2R)-2-formylpyrrolidine-1-carboxylate;tert-Butyl(2R)-2-formylpyrrolidine-1-carboxylate; |
| EINECS: | 624-637-4 |
| Density: | 1.148 |
| Boiling Point: | 276.345 °C at 760 mmHg |
| Flash Point: | 120.929 °C |
| Appearance: | Clear colorless to yellow liquid |
| Hazard Symbols: |
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 46.61000 |
| LogP: | 1.52270 |
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Specification
The N-(tert-Butoxycarbonyl)-D-prolinal , with cas registry number of 73365-02-3, is a kind of categories of Amino Aldehydes; Amino Acid Derivatives; Peptide Synthesis. Its appearance is clear colorless to yellow liquid. Both IUPAC name and systematic name are called the same which is tert-butyl 2-formylpyrrolidine-1-carboxylate .
Physical properties of N-(tert-Butoxycarbonyl)-D-prolinal are: (1) ACD/LogP: 1.13 ; (2) # of Rule of 5 Violations: 0 ; (3) ACD/LogD (pH 5.5): 1.127 ; (4) ACD/LogD (pH 7.4): 1.127 ; (5) ACD/BCF (pH 5.5): 4.232 ; (6) ACD/BCF (pH 7.4): 4.232 ; (7) ACD/KOC (pH 5.5): 97.752 ; (8) ACD/KOC (pH 7.4): 97.752 ; (9) #H bond acceptors: 4 ; (10) #H bond donors: 0 ; (11) #Freely Rotating Bonds: 3 ; (12) Index of Refraction: 1.528 ; (13) Molar Refractivity: 53.437 cm3 ; (14) Molar Volume: 173.536 cm3 ; (15) Surface Tension: 47.654 dyne/cm ; (16) Density: 1.148 g/cm3 ; (17) Flash Point: 120.929 °C ; (18) Enthalpy of Vaporization: 51.485 kJ/mol ; (19) Boiling Point: 276.345 °C at 760 mmHg ; (20) Vapour Pressure: 0.005 mmHg at 25°C ; (21) Refractive index: n20/D 1.461(lit.).
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. Remember wear suitable protective clothing before use it. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. After use it, store it at the temperature of -20°C.
You can still convert the following datas into molecular structure:
(1) SMILES:CC(C)(C)OC(=O)N1CCCC1C=O;
(2) InChI:InChI=1/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H3;
(3) InChIKey:YDBPZCVWPFMBDH-UHFFFAOYAP