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| CAS No.: | 91188-13-5 |
|---|---|
| Name: | 3-N-Boc-amino-azetidine |
| Article Data: | 4 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H16N2O2 |
| Molecular Weight: | 172.227 |
| Synonyms: | Azetidin-3-ylcarbamic acidtert-butyl ester;Azetidin-3-ylcarbamic acid tert-butyl ester;Azetidine-3-ylcarbamic acid tert-butyl ester;N-(Azetidin-3-yl)carbamic acidtert-butyl ester;tert-Butyl N-azetidin-3-ylcarbamate;tert-Butylazetidin-3-ylcarbamate;Carbamicacid, 3-azetidinyl-, 1,1-dimethylethyl ester (9CI);1,1-Dimethylethyl3-azetidinylcarbamate;3-(tert-Butoxycarbonylamino)azetidine;3-[N-(tert-Butyloxycarbonyl)amino]azetidine; |
| EINECS: | 676-108-2 |
| Density: | 1.06 g/cm3 |
| Melting Point: | 63-72°C |
| Boiling Point: | 267.5 °C at 760 mmHg |
| Flash Point: | 115.6 °C |
| Solubility: | Soluble in water. (5g/100ml) |
| Appearance: | white powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 50.36000 |
| LogP: | 1.20260 |
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Chemistry
Molecular Structure :
IUPAC Name:tert-butyl N-(azetidin-3-yl)carbamate
Molecular Formula:C8H16N2O2
Molecular Weight:172.224840 g/mol
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 32.78Å2
Index of Refraction: 1.48
Surface Tension: 35.7 dyne/cm
Molar Refractivity: 46.18 cm3
Molar Volume: 162.3 cm3
Density: 1.06 g/cm3
Flash Point: 115.6 °C
Enthalpy of Vaporization: 50.56 kJ/mol
Boiling Point: 267.5 °C at 760 mmHg
Appearance: white solid
Categories of 3-N-Boc-amino-azetidine (CAS NO.91188-13-5): N-BOC; Heterocycles series; pharmacetical; Amines; Azetidine; Azetidines; Ring Systems
SMILES: O=C(OC(C)(C)C)NC1CNC1
InChI: InChI=1/C8H16N2O2/c1-8(2,3)12-7(11)10-6-4-9-5-6/h6,9H,4-5H2,1-3H3,(H,10,11)
Safety Profile
Safety Information of 3-N-Boc-amino-azetidine (CAS NO.91188-13-5):
Hazard Codes: 
Xi
Risk Statements: 36/37/38
36/37/38:Irritating to eyes, respiratory system and skin
Safety Statements: 26-36/37/39
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37/39:Wear suitable protective clothing, gloves and eye/face protection
Specification
3-N-Boc-amino-azetidine , its cas register number is 91188-13-5. It also can be called Tert-butyl azetidin-3-ylcarbamate ; azetidin-3-yl-carbamic acid tert-butyl ester ; 3-aminoazetidine, 3-boc protected ; 3-boc-aminoazetidine ; carbamic acid, 3-azetidinyl-, 1,1-dimethylethyl ester (9Cl) ; 3-aminoazetidine, 3-boc protected 97% ; 3-boc-aminoazetidine 98% .